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Cayman Chemical Company
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1180 E.Ellsworth Rd.
Ann Arbor, MI 48108
800-364-9897
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800-364-9897 (Customer Service)
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888-526-5351 (Technical Services)
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TAURINE
CAS:107-35-7
Formula: C2H7NO3S
27031
OS(CCN)(=O)=O
TAURINE-D4
CAS:342611-14-7
Formula: C2H3D4NO3S
35211
O=S(C([2H])([2H])C([2H])([2H])N)(O)=O
TAURO-?-MURICHOLIC ACID (SODIUM SALT)
CAS:2456348-84-6
Formula: C26H44NO7S • Na
28842
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)[C@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAURO-A-MURICHOLIC ACID (SODIUM SALT)
CAS:2260905-08-4
Formula: C26H44NO7S • Na
20288
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)[C@@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAURO-A-MURICHOLIC ACID-D4 (SODIUM SALT)
Formula: C26H40D4NO7S • Na
27039
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)[C@@H](O)[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAURO-D4-URSODEOXYCHOLIC ACID
CAS:2573035-17-1
Formula: C26H41D4NO6S
39851
C[C@@]12[C@](CC[C@]2([H])[C@H](C)CCC(NC([2H])([2H])C([2H])([2H])S(O)(=O)=O)=O)([H])[C@@]3([H])[C@@](CC1)([H])[C@@]4([C@](C[C@@H](CC4)O)([H])C[C@@H]3O)C
TAURO-OBETICHOLIC ACID
CAS:863239-61-6
Formula: C28H49NO6S
28243
CC[C@@H]1[C@]2([H])C[C@H](O)CC[C@]2(C)[C@]3([H])[C@@]([C@@](CC[C@]4([H])[C@@H](CCC(NCCS(O)(=O)=O)=O)C)([H])[C@]4(C)CC3)([H])[C@@H]1O
Tauro-Obeticholic Acid (sodium salt)
CAS:2278141-79-8
Formula: C28H48NO6S • Na
38878
CC[C@@H]1[C@]2([H])C[C@H](O)CC[C@]2(C)[C@]3([H])[C@@]([C@@](CC[C@]4([H])[C@@H](CCC(NCCS([O-])(=O)=O)=O)C)([H])[C@]4(C)CC3)([H])[C@@H]1O.[Na+]
Tauro-ß-muricholic Acid (sodium salt)
CAS:145022-92-0
Formula: C26H44NO7S • Na
20289
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)[C@@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
Tauro-ß-muricholic Acid-d4 (sodium salt)
Formula: C26H40D4NO7S • Na
27040
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)[C@@H](O)[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROCHENODEOXYCHOLIC ACID (SODIUM SALT)
CAS:6009-98-9
Formula: C26H44NO6S • Na
20275
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROCHENODEOXYCHOLIC ACID-D4 (SODIUM SALT)
CAS:2410279-85-3
Formula: C26H40D4NO6S • Na
21905
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROCHOLIC ACID (SODIUM SALT)
CAS:145-42-6
Formula: C26H44NO7S • Na
16215
O[C@@H]1C[C@]2([H])C[C@H](O)CC[C@]2(C)[C@]3([H])[C@]1([H])[C@@](CC[C@]4([H])[C@@H](CCC(NCCS([O-])(=O)=O)=O)C)([H])[C@]4(C)[C@@H](O)C3.[Na+]
TAUROCHOLIC ACID 3-SULFATE (SODIUM SALT)
CAS:71781-33-4
Formula: C26H43NO10S2 • 2Na
9.00254e+006
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](OS([O-])(=O)=O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C.[Na+].[Na+]
TAUROCHOLIC ACID-D4 (SODIUM SALT)
CAS:2410279-93-3
Formula: C26H40D4NO7S • Na
21891
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C.[Na+]
TAURODEOXYCHOLIC ACID (SODIUM SALT HYDRATE)
CAS:207737-97-1
Formula: C26H44NO6S • Na [XH2O]
15935
O[C@@H]1CC[C@@]2(C)[C@@](CC[C@]3([H])[C@]2([H])C[C@H](O)[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCC(NCCS(=O)([O-])=O)=O)([H])C1.[Na+].O
TAURODEOXYCHOLIC ACID-D4 (SODIUM SALT)
CAS:2410279-82-0
Formula: C26H40D4NO6S • Na
32983
[H][C@]12[C@@]([C@@](CC[C@]3([H])[C@H](C)CCC(NCCS(=O)([O-])=O)=O)([H])[C@]3(C)[C@@H](O)C2)([H])CC[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@@]41C.[Na+]
TAUROHYOCHOLIC ACID (SODIUM SALT)
CAS:117997-17-8
Formula: C26H44NO7S • Na
22669
O[C@@H]1CC[C@@]2(C)[C@@]([C@@H](O)[C@@H](O)[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCC(NCCS(O)(=O)=O)=O)([H])C1.[Na+]
TAUROHYOCHOLIC ACID-D4 (SODIUM SALT)
Formula: C26H40D4NO7S • Na
27038
O[C@@H]1C([2H])([2H])C[C@@]2(C)[C@@]([C@@H](O)[C@@H](O)[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCC(NCCS([O-])(=O)=O)=O)([H])C1([2H])[2H].[Na+]
TAUROHYODEOXYCHOLIC ACID (SODIUM SALT)
CAS:38411-85-7
Formula: C26H44NO6S • Na
21956
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])C[C@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROLIDINE
CAS:19388-87-5
Formula: C7H16N4O4S2
15374
O=S1(CCN(CN2CNS(CC2)(=O)=O)CN1)=O
TAUROLITHOCHOLIC ACID (SODIUM SALT)
CAS:6042-32-6
Formula: C26H44NO5S • Na
17275
O=C(NCCS([O-])(=O)=O)CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROLITHOCHOLIC ACID 3-SULFATE (SODIUM SALT)
CAS:64936-83-0
Formula: C26H43NO8S2 • 2Na
18468
O=C(NCCS([O-])(=O)=O)CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@H](OS([O-])(=O)=O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+].[Na+]
TAUROLITHOCHOLIC ACID-D4 (SODIUM SALT)
CAS:2410279-97-7
Formula: C26H40D4NO5S • Na
32984
O=C(NCCS([O-])(=O)=O)CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAUROURSODEOXYCHOLIC ACID
CAS:14605-22-2
Formula: C26H45NO6S
20277
C[C@H](CCC(NCCS(O)(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C
TAUROURSODEOXYCHOLIC ACID (SODIUM SALT HYDRATE)
Formula: C26H44NO6S • Na [XH2O]
9.00338e+006
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+].O
TAUROURSODEOXYCHOLIC ACID-D4 (SODIUM SALT)
CAS:2410279-95-5
Formula: C26H40D4NO6S • Na
32985
C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
TAZAROTENE
CAS:118292-40-3
Formula: C21H21NO2S
23559
O=C(OCC)C1=CC=C(C#CC2=CC(C(C)(C)CCS3)=C3C=C2)N=C1
TAZAROTENIC ACID
CAS:118292-41-4
Formula: C19H17NO2S
21367
OC(C1=CC=C(C#CC2=CC(C(C)(C)CCS3)=C3C=C2)N=C1)=O
TAZOBACTAM
CAS:89786-04-9
Formula: C10H12N4O5S
25679
O=C(C1)N2[C@]1([H])S([C@](CN3C=CN=N3)(C)[C@@H]2C(O)=O)(=O)=O
TAZOBACTAM (SODIUM SALT)
CAS:89785-84-2
Formula: C10H11N4O5S • Na
17185
O=C(C1)N2[C@]1([H])S([C@](CN3C=CN=N3)(C)[C@@H]2C([O-])=O)(=O)=O.[Na+]
TB 21007
CAS:207306-50-1
Formula: C15H17NO2S3
27674
O=C1C2=C(SCCO)SC(C3=NC=CS3)=C2CC(C)(C)C1
TB5
CAS:948841-07-4
Formula: C15H14BrNOS
22947
CN(C)C1=CC=C(/C=C/C(C2=CC=C(Br)S2)=O)C=C1
TBA-354
CAS:1257426-19-9
Formula: C19H15F3N4O5
30317
FC(F)(F)OC1=CC=C(C2=CC=C(CO[C@H]3CN4C(OC3)=NC([N+]([O-])=O)=C4)C=N2)C=C1
TBB
CAS:17374-26-4
Formula: C6HBr4N3
14453
BrC1=C2C(NN=N2)=C(Br)C(Br)=C1Br
TBCA
CAS:934358-00-6
Formula: C9H4Br4O2
14831
BrC1=C(Br)C(Br)=C(Br)C=C1/C=C/C(O)=O
TBPB
CAS:634616-95-8
Formula: C25H32N4O
22943
CC(C=CC=C1)=C1CN(CC2)CCC2N3CCC(N4C(NC5=C4C=CC=C5)=O)CC3
TBS-COREY LACTONE ALDEHYDE
CAS:64091-14-1
Formula: C14H24O4Si
70031
O=C1C[C@@H]2[C@@H](C=O)[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]2O1
TBTA
CAS:510758-28-8
Formula: C30H30N10
18816
C1(CN(CC2=CN(CC3=CC=CC=C3)N=N2)CC4=CN(CC5=CC=CC=C5)N=N4)=CN(CC6=CC=CC=C6)N=N1
TC 14012 (hydrochloride)
Formula: C90H140N34O19S2 • XHCl
38140
O=C(N[C@H](C(N[C@@](C(N[C@H](C(N[C@](CSSC[C@H](NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@@H](N)CCCNC(N)=N)=O)=O)CC1=CC(C=CC=C2)=C2C=C1)=O)C3=O)([H])C(N[C@H](C(N)=O)CCCNC(N)=N)=O)=O)CCCNC(N)=O)=O)([H])CCCNC(N)=N)=O)CC4=CC=C(O)C=C4)[C@@](CCC5)([H])N5C([C@@](NC([C
TC 14012 (TRIFLUOROACETATE SALT)
Formula: C90H140N34O19S2 • XCF3COOH
11974
O=C(N[C@H](C(N[C@@](C(N[C@H](C(N[C@](CSSC[C@H](NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@@H](N)CCCNC(N)=N)=O)=O)CC1=CC(C=CC=C2)=C2C=C1)=O)C3=O)([H])C(N[C@H](C(N)=O)CCCNC(N)=N)=O)=O)CCCNC(N)=O)=O)([H])CCCNC(N)=N)=O)CC4=CC=C(O)C=C4)[C@@](CCC5)([H])N5C([C@@](NC([C
TC 2559 (FUMARATE)
CAS:212332-35-9
Formula: C12H18N2O • 2C4H4O4
25600
CNCC/C=C/C1=CC(OCC)=CN=C1.OC(/C=C/C(O)=O)=O.OC(/C=C\C(O)=O)=O
TC HSD 21
CAS:330203-01-5
Formula: C17H12BrNO3S2
29730
OC1=CC=C(/C=C2SC(N(C3=CC=C(OC)C=C3)C\2=O)=S)C=C1Br
TC LPA5 4
CAS:1393814-38-4
Formula: C23H23ClN2O3
17719
ClC1=C(C2CCCCC2)C=CC(C3=CC(C(O)=O)=NN3C4=CC=CC(OC)=C4)=C1
TC-E 5002
CAS:1453071-47-0
Formula: C15H27NO4
17717
O=C(O)CCN(C(CCCCCCCCC1CC1)=O)O
TC-E 5003
CAS:17328-16-4
Formula: C16H14Cl2N2O4S
17718
ClCC(NC1=CC=C(S(C2=CC=C(NC(CCl)=O)C=C2)(=O)=O)C=C1)=O
TC-E3 5032
CAS:835616-60-9
Formula: C13H9FN2O4
26147
O=C(C1=C2C=CC=C1F)N(C3C(NC(CC3)=O)=O)C2=O
TC-FPR 43
CAS:903895-98-7
Formula: C20H21ClN4O2
29804
ClC1=CC=C(NC(NC2=C(C(C)C)N(C)N(C3=CC=CC=C3)C2=O)=O)C=C1
TC-I 2000
CAS:1159996-20-9
Formula: C23H18F4N2O
35463
O=C(N1CCC2=CC=CC=C2C1C3=CC=C(C(F)(F)F)C=C3)NC4=CC=C(C=C4)F
TC-O 9311
CAS:444932-31-4
Formula: C20H19N3O4
14030
COC1=CC(OC)=CC(C(NNC(NC2=CC=CC3=C2C=CC=C3)=O)=O)=C1
TC-S 7001
CAS:867017-68-3
Formula: C18H13ClF2N6O
19129
ClC1=NC(N)=NC(NC2=CC(F)=C(OC3=CC=NC4=C3C(C)=CN4)C(F)=C2)=C1
TCEP-biotin
CAS:2227020-26-8
Formula: C25H43N4O9PS
25365
OC(CCP(CCC(NCCOCCOCCNC(CCCC[C@@H]1SC[C@@](N2)([H])[C@]1([H])NC2=O)=O)=O)CCC(O)=O)=O
TCH-165
CAS:1446350-60-2
Formula: C39H37N3O3
40454
CCOC([C@@]1(C2=CC=CC=C2)[C@@H](C3=CC=C(NCC4=CC=CC=C4)C=C3)N(C(C5=CC=C(C=C5)OC)=N1)CC6=CC=CC=C6)=O
TCID
CAS:30675-13-9
Formula: C9H2Cl4O2
16353
O=C(CC1=O)C2=C1C(Cl)=C(Cl)C(Cl)=C2Cl
TCN 201
CAS:852918-02-6
Formula: C21H17ClFN3O4S
19086
O=C(NNC(C1=CC=C(CNS(C2=CC(Cl)=C(F)C=C2)(=O)=O)C=C1)=O)C3=CC=CC=C3
TCN 238
CAS:125404-04-8
Formula: C12H11N3
11994
NC1=NC=CC(/C=C/C2=CC=CC=C2)=N1
TCPOBOP
CAS:76150-91-9
Formula: C16H8Cl4N2O2
14140
ClC1=CN=C(OC2=CC=C(OC3=C(Cl)C=C(Cl)C=N3)C=C2)C(Cl)=C1
TCS 1102
CAS:916141-36-1
Formula: C27H26N4O2S
18495
O=C(N1[C@@H](C(NC2=C(C3=CC=CC=C3)C=CC=C2)=O)CCC1)CSC4=NC5=CC=CC=C5N4C
TCS 21311
CAS:1260181-14-3
Formula: C27H25F3N4O4
30063
O=C(N1)C(C2=CNC3=CC=CC=C32)=C(C4=C(C(F)(F)F)C=CC(N5CCN(C(C(C)(O)C)=O)CC5)=C4)C1=O
TCS 2210
CAS:1201916-31-5
Formula: C18H17N3O3
16142
O=C(NO)C1=CC=C(NC(C(CCCC2=CC=CC=C2)=N3)=O)C3=C1
TCS 401
CAS:243966-09-8
Formula: C10H10N2O5S • HCl
20393
OC(C1=C(NC(C(O)=O)=O)SC2=C1CCNC2)=O.Cl
TCS 5861528
CAS:332117-28-9
Formula: C19H23N5O3
18380
CN(C(N1C)=O)C2=C(N(CC(NC3=CC=C(C(CC)C)C=C3)=O)C=N2)C1=O
TCS ERK 11E
CAS:896720-20-0
Formula: C24H20Cl2FN5O2
19932
FC1=CC=C(NC2=NC=C(C)C(C3=CNC(C(N[C@H](CO)C4=CC(Cl)=CC=C4)=O)=C3)=N2)C(Cl)=C1
TCS PIM-1 1
CAS:491871-58-0
Formula: C18H11BrN2O2
16286
O=C1NC(C2=C(O)C=CC(Br)=C2)=CC(C3=CC=CC=C3)=C1C#N
TCS-OX2-29
CAS:1610882-30-8
Formula: C23H31N3O3 • HCl
17419
COC1=C(OC)C=C(CN(C([C@H](C(C)(C)C)NCC2=CC=NC=C2)=O)CC3)C3=C1.Cl
tcY-NH2 (trifluoroacetate salt)
Formula: C40H49N7O7 • XCF3COOH
36758
NC([C@H](CC1=CC=CC=C1)NC([C@H](CCCCN)NC(CNC([C@H]2N(C([C@@H](NC(/C=C/C3=CC=CC=C3)=O)CC4=CC=C(O)C=C4)=O)CCC2)=O)=O)=O)=O.OC(C(F)(F)F)=O
TD-4208
CAS:864750-70-9
Formula: C35H43N5O4
36549
O=C(NC1=C(C2=CC=CC=C2)C=CC=C1)OC3CCN(CC3)CCN(C)C(C4=CC=C(CN5CCC(CC5)C(N)=O)C=C4)=O
TD52
CAS:1798328-24-1
Formula: C24H16N4
37744
C#CC1=CC=CC(NC2=NC3=C(N=C2NC4=CC(C#C)=CC=C4)C=CC=C3)=C1
TDFA (TRIFLUOROACETATE SALT)
Formula: C17H29FN6O7 • XCF3COOH
22484
O=C(O)C(F)(F)F.C[C@@H](O)[C@H](NC(C)=O)C(N[C@H](C(N[C@H](C(N)=O)CCCNC(CF)=N)=O)CC(O)=O)=O
TDI-10229
CAS:2810887-45-5
Formula: C16H16ClN5
37674
NC1=NC(Cl)=CC(C2=NN(C)C(C)=C2CC3=CC=CC=C3)=N1
TDI-11861
CAS:2857049-72-8
Formula: C22H25ClF2N6O3
39922
NC1=NC(Cl)=CC(C2=NN(C(F)F)C=C2CC3=C(OCCN4[C@H](CO)COCC4)C=CC=C3)=N1
TDIQ (HYDROCHLORIDE)
CAS:15052-05-8
Formula: C10H11NO2 • HCl
16083
C1(CCNC2)=C2C=C(OCO3)C3=C1.Cl
TDTBPP
CAS:95906-11-9
Formula: C42H63O4P
39138
O=[P](OC(C=CC(C(C)(C)C)=C1)=C1C(C)(C)C)(OC(C=CC(C(C)(C)C)=C2)=C2C(C)(C)C)OC(C=CC(C(C)(C)C)=C3)=C3C(C)(C)C
TDZD-8
CAS:327036-89-5
Formula: C10H10N2O2S
16287
O=C1SN(C)C(N1CC2=CC=CC=C2)=O
TEBIPENEM (HYDRATE)
Formula: C16H21N3O4S2 • XH2O
33875
OC(C1=C(SC2CN(C3=NCCS3)C2)[C@H](C)[C@@]([C@]4([C@H](O)C)[H])([H])N1C4=O)=O.OOC(C1=C(SC2CN(C3=NCCS3)C2)[C@H](C)[C@@]([C@]4([C@H](O)C)[H])([H])N1C4=O)=O.O
TEBIPENEM PIVOXIL
CAS:161715-24-8
Formula: C22H31N3O6S2
30613
O=C1N2C(C(OCOC(C(C)(C)C)=O)=O)=C(SC3CN(C4=NCCS4)C3)[C@H](C)[C@]2([H])[C@@]1([H])[C@H](O)C
TEBUCONAZOLE
CAS:107534-96-3
Formula: C16H22ClN3O
24052
ClC1=CC=C(CCC(C(C)(C)C)(O)CN2N=CN=C2)C=C1
TEBUCONAZOLE-D9
CAS:1246818-83-6
Formula: C16H13ClD9N3O
33287
ClC(C=C1)=CC=C1CCC(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])(O)CN2C=NC=N2
TEBUFENOZIDE
CAS:112410-23-8
Formula: C22H28N2O2
24055
CCC1=CC=C(C(NN(C(C)(C)C)C(C2=CC(C)=CC(C)=C2)=O)=O)C=C1
TECADENOSON
CAS:204512-90-3
Formula: C14H19N5O5
28449
OC[C@H]([C@@H](O)[C@H]1O)O[C@@]1([H])N2C=NC3=C(N[C@@H]4CCOC4)N=CN=C32
TECHTOCHRYSIN
CAS:520-28-5
Formula: C16H12O4
35791
O=C1C=C(C2=CC=CC=C2)OC3=C1C(O)=CC(OC)=C3
TECTORIDIN
CAS:611-40-5
Formula: C22H22O11
33969
O=C1C2=C(O)C(OC)=C(O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)C=C2OC=C1C4=CC=C(C=C4)O
TECTORIGENIN
CAS:548-77-6
Formula: C16H12O6
35860
O=C1C(C2=CC=C(O)C=C2)=COC3=CC(O)=C(C(O)=C13)OC
TEDIZOLID
CAS:856866-72-3
Formula: C17H15FN6O3
32952
FC1=C(C2=CN=C(C3=NN(C)N=N3)C=C2)C=CC(N4C[C@H](CO)OC4=O)=C1
TEDIZOLID PHOSPHATE
CAS:856867-55-5
Formula: C17H16FN6O6P
23729
FC1=C(C2=CN=C(C3=NN(C)N=N3)C=C2)C=CC(N4C(O[C@@H](COP(O)(O)=O)C4)=O)=C1
TEDIZOLID-13C-D3
CAS:2931763-72-1
Formula: C16[13C]H12D3FN6O3
33290
FC1=CC(N2C[C@H](CO)OC2=O)=CC=C1C3=CN=C(C4=NN([13C]([2H])([2H])[2H])N=N4)C=C3
TEGASEROD (MALEATE)
CAS:189188-57-6
Formula: C16H23N5O • C4H4O4
14692
COC(C=C1)=CC2=C1NC=C2/C=N/NC(NCCCCC)=N.OC(/C=C\C(O)=O)=O
TEGATRABETAN
CAS:1227637-23-1
Formula: C28H36N4O6S2
37423
ON=C1C2=CC(S(=O)(N3C[C@H](C[C@H](C3)C)C)=O)=CC=C2C(C4=CC=C(S(=O)(N5C[C@H](C[C@H](C5)C)C)=O)C=C41)=NO
TEGOBUVIR
CAS:1000787-75-6
Formula: C25H14F7N5
36603
FC1=C(C2=NC3=CN(CC4=CC=C(C5=C(C(F)(F)F)C=C(C(F)(F)F)C=C5)N=N4)C=CC3=N2)C=CC=C1
TEGOPRAZAN
CAS:942195-55-3
Formula: C20H19F2N3O3
33243
CN(C)C(C1=CC(O[C@@H]2C3=C(F)C=C(F)C=C3OCC2)=C4C(N=C(N4)C)=C1)=O
TEICOPLANIN A2-3
CAS:91032-36-9
Formula: C88H97Cl2N9O33
20188
O[C@@H]([C@H](O)[C@@H](CO)O1)[C@H](O)[C@H]1OC2=CC(O)=CC([C@@H](C(O)=O)NC([C@@]([C@@H](C3=CC(Cl)=C(OC4=CC5=CC(OC6=CC=C7C=C6Cl)=C4O[C@H]8[C@H](NC(CCCCCCCCC)=O)[C@@H](O)[C@H](O)[C@@H](CO)O8)C=C3)O[C@]9([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9NC(C)=O)([H])NC%10=
TEICOPLANIN A2-4
CAS:91032-37-0
Formula: C89H99Cl2N9O33
20189
O[C@@H]([C@H](O)[C@@H](CO)O1)[C@H](O)[C@H]1OC2=CC(O)=CC([C@@H](C(O)=O)NC([C@@]([C@@H](C3=CC(Cl)=C(OC4=CC5=CC(OC6=CC=C7C=C6Cl)=C4O[C@H]8[C@H](NC(CCCCCCC(C)CC)=O)[C@@H](O)[C@H](O)[C@@H](CO)O8)C=C3)O[C@]9([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9NC(C)=O)([H
TEICOPLANIN A2-5
CAS:91032-38-1
Formula: C89H99Cl2N9O33
20192
O[C@@H]([C@H](O)[C@@H](CO)O1)[C@H](O)[C@H]1OC2=CC(O)=CC([C@@H](C(O)=O)NC([C@@]([C@@H](C3=CC(Cl)=C(OC4=CC5=CC(OC6=CC=C7C=C6Cl)=C4O[C@H]8[C@H](NC(CCCCCCCC(C)C)=O)[C@@H](O)[C@H](O)[C@@H](CO)O8)C=C3)O[C@]9([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9NC(C)=O)([H
TEICOPLANIN A3-1
CAS:93616-27-4
Formula: C72H68Cl2N8O28
20193
O[C@@H]([C@H](O)[C@@H](CO)O1)[C@H](O)[C@H]1OC2=CC(O)=CC([C@@H](C(O)=O)NC([C@@]([C@@H](C3=CC(Cl)=C(OC4=CC5=CC(OC6=CC=C7C=C6Cl)=C4O)C=C3)O[C@]8([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8NC(C)=O)([H])NC9=O)=O)=C2C%10=C(O)C=CC([C@@]9([H])NC([C@]5([H])NC([C@@]
TEICOPLANIN COMPLEX
CAS:61036-62-2
Formula: C88H95Cl2N9O33 (for A2-1)
15511
O[C@@H]([C@H](O)[C@@H](CO)O1)[C@H](O)[C@H]1OC2=CC(O)=CC([C@@H](C(O)=O)NC([C@@]([C@@H](C3=CC(Cl)=C(OC4=CC5=CC(OC6=CC=C7C=C6Cl)=C4O[C@H]8[C@@H](N[R])[C@H](O)[C@@H](O)[C@H](CO)O8)C=C3)O[C@]9([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9NC(C)=O)([H])NC%10=O)=O)=
TEIJIN COMPOUND 1 (HYDROCHLORIDE)
CAS:1313730-14-1
Formula: C21H21ClF3N3O2 • HCl
30977
O=C(CNC(C1=CC(C(F)(F)F)=CC=C1)=O)N[C@@H]2CCN(CC3=CC=C(Cl)C=C3)C2.Cl
TELAPREVIR
CAS:402957-28-2
Formula: C36H53N7O6
20054
O=C(N[C@@H](C1CCCCC1)C(N[C@@H](C(C)(C)C)C(N2[C@H](C(N[C@H](C(C(NC3CC3)=O)=O)CCC)=O)[C@](CCC4)([H])[C@]4([H])C2)=O)=O)C5=NC=CN=C5
TELAPREVIR-D4
Formula: C36H49D4N7O6
31317
O=C(N[C@@H](C1CCCCC1)C(N[C@@H](C(C)(C)C)C(N2[C@H](C(N[C@H](C(C(NC3C([2H])([2H])C3([2H])[2H])=O)=O)CCC)=O)[C@](CCC4)([H])[C@]4([H])C2)=O)=O)C5=NC=CN=C5
TELATINIB
CAS:332012-40-5
Formula: C20H16ClN5O3
26203
O=C(NC)C1=CC(COC2=C(OC=C3)C3=C(NC4=CC=C(Cl)C=C4)N=N2)=CC=N1
TELBIVUDINE
CAS:3424-98-4
Formula: C10H14N2O5
21453
O=C(C(C)=CN1[C@H]2O[C@@H](CO)[C@H](O)C2)N([H])C1=O
TELMISARTAN
CAS:144701-48-4
Formula: C33H30N4O2
11615
CC1=CC(C2=NC3=C(C=CC=C3)N2C)=CC4=C1N=C(CCC)N4CC5=CC=C(C6=CC=CC=C6C(O)=O)C=C5
Telmisartan Acyl-ß-D-Glucuronide (hydrate)
Formula: C39H38N4O8 • XH2O
28056
CC1=CC(C2=NC3=C(C=CC=C3)N2C)=CC4=C1N=C(CCC)N4CC5=CC=C(C6=CC=CC=C6C(O[C@@H]7O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]7O)=O)C=C5
TELMISARTAN-D3
CAS:1189889-44-8
Formula: C33H27D3N4O2
22568
CC1=CC(C2=NC3=C(C=CC=C3)N2C([2H])([2H])[2H])=CC4=C1N=C(CCC)N4CC5=CC=C(C6=CC=CC=C6C(O)=O)C=C5
TELOCINOBUFAGIN
CAS:472-26-4
Formula: C24H34O5
27981
O[C@H]1CC[C@@]2(C)[C@@](CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@]3(O)CC[C@@H]4C5=COC(C=C5)=O)(O)C1
TELOMYCIN
CAS:19246-24-3
Formula: C59H77N13O19
28137
O=C1O[C@H](C)[C@H](NC([C@@H](NC(C[C@H](N)C(O)=O)=O)CO)=O)C(N[C@]([C@@H](O)C)([H])C(N[C@@H](C)C(NCC(N2[C@]([C@@H](O)CC2)([H])C(N/C(C(N[C@](C(C)C3=CNC4=C3C=CC=C4)([H])C(NC([C@H](C(C)C)O)C(N5[C@@]1([H])[C@H](O)CC5)=O)=O)=O)=C\C6=CNC7=C6C=CC=C7)=O)=O)=O)=O)=O
TELOTRISTAT
CAS:1033805-28-5
Formula: C25H22ClF3N6O3
29424
NC1=NC(C2=CC=C(C[C@H](N)C(O)=O)C=C2)=CC(O[C@H](C3=CC=C(Cl)C=C3N4C=CC(C)=N4)C(F)(F)F)=N1
TELOTRISTAT ETIPRATE
CAS:1137608-69-5
Formula: C27H26ClF3N6O3 • C9H9NO3
25342
NC1=NC(O[C@@H](C(F)(F)F)C2=CC=C(Cl)C=C2N3N=C(C)C=C3)=CC(C4=CC=C(C[C@H](N)C(OCC)=O)C=C4)=N1.O=C(NCC(O)=O)C5=CC=CC=C5
TELRATOLIMOD
CAS:1359993-59-1
Formula: C36H59N5O2
33172
O=C(CCCCCCCCCCCCCCCCC)NCCCCON1C(CCCC)=NC2=C1C3=C(C=CC=C3)N=C2N
TEMAFLOXACIN
CAS:108319-06-8
Formula: C21H18F3N3O3
17352
CC1CN(C2=C(F)C=C(C(C(C(O)=O)=CN3C4=CC=C(F)C=C4F)=O)C3=C2)CCN1
TEMOCAPRIL (HYDROCHLORIDE)
CAS:110221-44-8
Formula: C23H28N2O5S2 • HCl
18241
OC(CN1C([C@@H](N[C@@H](CCC2=CC=CC=C2)C(OCC)=O)CS[C@H](C3=CC=CS3)C1)=O)=O.Cl
TEMOCAPRILAT
CAS:110221-53-9
Formula: C21H24N2O5S2
22169
OC([C@@H](N[C@H]1CS[C@H](C2=CC=CS2)CN(CC(O)=O)C1=O)CCC3=CC=CC=C3)=O
TEMOPORFIN
CAS:122341-38-2
Formula: C44H32N4O4
17333
OC1=CC(/C2=C3[NH]/C(C=C/3)=C(C4=CC=CC(O)=C4)\C5=[N]/C(C=C5)=C(C6=CC(O)=CC=C6)\C7=CC=C(/C(C8=CC(O)=CC=C8)=C9[N]=C2CC\9)[NH]7)=CC=C1
TEMOZOLOMIDE ACID
CAS:113942-30-6
Formula: C6H5N5O3
35800
O=C(C(N=CN12)=C2N=NN(C)C1=O)O
TEMOZOLOMIDE-D3
CAS:208107-14-6
Formula: C6H3D3N6O2
22372
O=C(N(C([2H])([2H])[2H])N=N1)N2C1=C(C(N)=O)N=C2
TEMPOL
CAS:2226-96-2
Formula: C9H18NO2
27051
[O]N1C(C)(C)CC(O)CC1(C)C
TEMPONE
CAS:2896-70-0
Formula: C9H16NO2
14877
O=C1CC(C)(C)N([O])C(C)(C)C1
TEMSIROLIMUS
CAS:162635-04-3
Formula: C56H87NO16
11590
O=C(O[C@](CC([C@H](C)/C=C(C)/[C@@H](O)[C@@H](OC)C([C@@H](C1)C)=O)=O)([H])[C@H](C)C[C@@H]2CC[C@@H](OC(C(C)(CO)CO)=O)[C@H](OC)C2)[C@@]3([H])N(C(C([C@@]4(O)[C@H](C)CC[C@](C[C@@H](/C(C)=C/C=C/C=C\[C@H]1C)OC)([H])O4)=O)=O)CCCC3
TENAPANOR (HYDROCHLORIDE)
CAS:1234365-97-9
Formula: C50H66Cl4N8O10S2 • 2HCl
32875
O=S(NCCOCCOCCNC(NCCCCNC(NCCOCCOCCNS(=O)(C1=CC=CC([C@@]2(CN(C)CC3=C(Cl)C=C(C=C23)Cl)[H])=C1)=O)=O)=O)(C4=CC([C@@]5([H])C6=CC(Cl)=CC(Cl)=C6CN(C5)C)=CC=C4)=O.Cl.Cl
TENATOPRAZOLE
CAS:113712-98-4
Formula: C16H18N4O3S
18717
COC1=CC=C2C(N1)=NC(S(CC3=C(C)C(OC)=C(C)C=N3)=O)=N2
TENELIGLIPTIN (HYDROBROMIDE HYDRATE)
CAS:1572583-29-9
Formula: C22H30N6OS • 2.5HBr [XH2O]
29515
CC1=NN(C2=CC=CC=C2)C(N3CCN([C@]4([H])CN[C@H](C(N5CSCC5)=O)C4)CC3)=C1.CC6=NN(C7=CC=CC=C7)C(N8CCN([C@]9([H])CN[C@H](C(N%10CSCC%10)=O)C9)CC8)=C6.Br.Br.Br.Br.Br.O
TENELLIN
CAS:53823-15-7
Formula: C21H23NO5
28090
OC1=CC=C(C(C(O)=C2C(/C=C/C(C)=C/[C@H](C)CC)=O)=CN(O)C2=O)C=C1
TENIDAP
CAS:120210-48-2
Formula: C14H9ClN2O3S
17413
NC(N(C1=CC=C(Cl)C=C1/C2=C(C3=CC=CS3)/O)C2=O)=O
TENIPOSIDE
CAS:29767-20-2
Formula: C32H32O13S
14425
[H][C@@]12O[C@H](C3=CC=CS3)OC[C@@]1([H])O[C@](O[C@@H]4C(C=C(OCO5)C5=C6)=C6[C@@H](C7=CC(OC)=C(O)C(OC)=C7)[C@]8([H])[C@]4([H])COC8=O)([H])[C@H](O)[C@H]2O
TENOCYCLIDINE (HYDROCHLORIDE)
CAS:1867-65-8
Formula: C15H23NS • HCl
17014
N1(CCCCC1)C2(C3=CC=CS3)CCCCC2.Cl
TENOFOVIR
CAS:147127-20-6
Formula: C9H14N5O4P
13874
C[C@@H](OC[P](O)(O)=O)CN1C2=NC=NC(N)=C2N=C1
TENOFOVIR DIPHOSPHATE (SODIUM SALT)
Formula: C9H16N5O10P3 • XNa
27057
O=P(OP(OP(O)(O)=O)(O)=O)(O)CO[C@H](C)CN1C=NC2=C(N)N=CN=C21.[Na]
TENOFOVIR DISOPROXIL (FUMARATE)
CAS:202138-50-9
Formula: C19H30N5O10P • C4H4O4
16922
O=P(OCOC(OC(C)C)=O)(OCOC(OC(C)C)=O)CO[C@H](C)CN1C=NC2=C(N)N=CN=C21.O=C(O)/C=C/C(O)=O
TENOFOVIR-D6
CAS:1020719-94-1
Formula: C9H8D6N5O4P
21071
OP(COC(C([2H])([2H])[2H])([2H])C([2H])([2H])N1C=NC2=C(N)N=CN=C21)(O)=O
TENOVIN-1
CAS:380315-80-0
Formula: C20H23N3O2S
13085
CC(=O)Nc1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)C(C)(C)C
TENOVIN-3
CAS:1011301-27-1
Formula: C18H21N3OS
16288
CC(C)(C)C1=CC=C(C(NC(NC2=CC=C(N)C=C2)=S)=O)C=C1
TENOVIN-6 (HYDROCHLORIDE)
CAS:1011301-29-3
Formula: C25H34N4O2S • HCl
13086
O=C(NC(NC1=CC=C(NC(CCCCN(C)C)=O)C=C1)=S)C2=CC=C(C(C)(C)C)C=C2.Cl
TENTOXIN
CAS:28540-82-1
Formula: C22H30N4O4
11442
O=C(/C(N(C)C([C@H](CC(C)C)NC([C@H](C)N1C)=O)=O)=C\C2=CC=CC=C2)NCC1=O
TENUIFOLIN
CAS:20183-47-5
Formula: C36H56O12
30617
CC1(C)CC[C@@]2(C(O)=O)[C@@](C3=CC[C@@]([C@](C[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@]5(C)C(O)=O)(C)[C@@]5([H])CC6)([H])[C@]6(C)[C@]3(CO)CC2)([H])C1
TENUIGENIN
CAS:2469-34-3
Formula: C30H45ClO6
28824
CC1(C)CC[C@@](CCC2=C3[C@@H](CCl)C[C@@]4([H])[C@@]2(C)CC[C@]5([H])[C@]4(C)C[C@H](O)[C@H](O)[C@@]5(C)C(O)=O)(C(O)=O)[C@@]3([H])C1
TEPHROSIN (SYNTHETIC)
CAS:76-80-2
Formula: C23H22O7
19840
CC(C=C1)(C)OC2=C1C(O3)=C(C=C2)C([C@@]([C@@]3([H])CO4)(O)C5=C4C=C(OC)C(OC)=C5)=O
TEPOXALIN
CAS:103475-41-8
Formula: C20H20ClN3O3
34849
ClC(C=C1)=CC=C1C2=CC(CCC(N(O)C)=O)=NN2C3=CC=C(OC)C=C3
TERAZOSIN (HYDROCHLORIDE)
CAS:63074-08-8
Formula: C19H25N5O4 • HCl
20216
COC1=C(OC)C=C(C(N)=NC(N2CCN(C(C3CCCO3)=O)CC2)=N4)C4=C1.Cl
TERBINAFINE (HYDROCHLORIDE)
CAS:78628-80-5
Formula: C21H25N • HCl
1.00116e+007
CN(C/C=C/C#CC(C)(C)C)CC1=CC=CC2=CC=CC=C21.Cl
TERBINAFINE-D3 (HYDROCHLORIDE)
CAS:1310012-15-7
Formula: C21H22D3N • HCl
26392
CC(C)(C)C#C/C=C/CN(C([2H])([2H])[2H])CC1=CC=CC2=CC=CC=C21.Cl
TERBUTALINE
CAS:23031-25-6
Formula: C12H19NO3
29337
OC1=CC(O)=CC(C(O)CNC(C)(C)C)=C1
TERBUTALINE (HEMISULFATE)
CAS:23031-32-5
Formula: C12H19NO3 • 1/2H2SO4
21292
OC1=CC(O)=CC(C(O)CNC(C)(C)C)=C1.OS(=O)(O)=O.OC2=CC(O)=CC(C(O)CNC(C)(C)C)=C2
TERBUTHYLAZINE
CAS:5915-41-3
Formula: C9H16ClN5
34192
ClC1=NC(NCC)=NC(NC(C)(C)C)=N1
TERCONAZOLE
CAS:67915-31-5
Formula: C26H31Cl2N5O3
23959
CC(C)N1CCN(C2=CC=C(OC[C@@H]3O[C@@](CN4C=NC=N4)(C5=C(Cl)C=C(Cl)C=C5)OC3)C=C2)CC1
TERFENADINE
CAS:50679-08-8
Formula: C32H41NO2
20305
CC(C)(C)C1=CC=C(C(O)CCCN2CCC(C(C3=CC=CC=C3)(O)C4=CC=CC=C4)CC2)C=C1
TERLIPRESSIN (ACETATE)
CAS:914453-96-6
Formula: C52H74N16O15S2 • XC2H4O2
27027
OC(C=C1)=CC=C1C[C@H](NC([C@@H](NC(CNC(CNC(CN)=O)=O)=O)CSSC[C@@H](C(N2CCC[C@H]2C(N[C@@H](CCCCN)C(NCC(N)=O)=O)=O)=O)NC([C@H](CC(N)=O)N3)=O)=O)C(N[C@@H](CC4=CC=CC=C4)C(N[C@@H](CCC(N)=O)C3=O)=O)=O.CC(O)=O
TERMITOMYCAMIDE B
CAS:1254277-89-8
Formula: C28H40N2O2
11190
CCCCC/C=C\C/C=C\CCCCCCCC(NCC(C1=CC2=C(C=CC=C2)N1)=O)=O
TERMITOMYCAMIDE E
CAS:1177258-62-6
Formula: C26H41NO2
11191
CCCCC/C=C\C/C=C\CCCCCCCC(NCCC1=CC=C(O)C=C1)=O
TERNATIN
CAS:148619-41-4
Formula: C37H67N7O8
20691
O=C(N[C@@H](CC(C)C)C(N(C)[C@H]1C)=O)[C@H](CC(C)C)N(C)C([C@H](C)N(C([C@]([C@H](CC)C)([H])NC([C@@](NC([C@@H](C)N(C)C1=O)=O)([H])[C@@H](C(C)C)O)=O)=O)C)=O
TERPENDOLE C
CAS:156967-65-6
Formula: C32H41NO5
26910
C/C(C)=C/[C@@H]1OC(C)(C)[C@@]2([H])O[C@@]3([H])CC[C@@]4(C)[C@](CC[C@]5([H])[C@]4(C)C6=C(C(C=CC=C7)=C7N6)C5)(O)[C@@]3(O8)[C@H]8[C@]2([H])O1
TERPENDOLE I
CAS:167612-17-1
Formula: C27H35NO5
29443
C[C@]12[C@@](CC3=C2NC4=C3C=CC=C4)([H])CC[C@@]5(O)[C@]67[C@](O[C@H](C(C)(O)C)[C@@H](O)[C@H]6O7)([H])CC[C@@]51C
TERPHENYLLIN
CAS:52452-60-5
Formula: C20H18O5
23480
OC1=CC=C(C2=C(OC)C(O)=C(C3=CC=C(O)C=C3)C(OC)=C2)C=C1
TERPINEOL
CAS:8000-41-7
Formula: C10H18O
23173
CC(O)(C)C1CCC(C)=CC1.C=C(C)C2CCC(C)(O)CC2.C/C(C)=C3CCC(C)(O)CC/3
TERPINOLENE
CAS:586-62-9
Formula: C10H16
21712
C/C(C)=C1CC=C(C)CC/1
TERRECYCLIC ACID
CAS:83058-94-0
Formula: C15H20O3
28117
O=C1C([C@]23[C@H](C(O)=O)CC[C@](C(C)(C)C3)([H])[C@@]2([H])C1)=C
TERREIC ACID
CAS:121-40-4
Formula: C7H6O4
1.00102e+007
O=C(C(O)=C1C)[C@H]2[C@H](O2)C1=O
TERREIN
CAS:582-46-7
Formula: C8H10O3
23496
O=C1[C@H](O)[C@@H](O)C(/C=C/C)=C1
TERRELUMAMIDE A
CAS:1802497-05-7
Formula: C20H20N6O7
29836
O=C1C2=NC(C(N[C@@H]([C@H](O)C)C(NC3=CC=CC=C3C(OC)=O)=O)=O)=CN=C2N(C)C(N1)=O
TERRITREM A
CAS:70407-19-1
Formula: C28H30O9
29941
O=C1C=CC(C)(C)[C@]([C@@]21C)(O)CC[C@@]([C@]2(O)C3)(C)OC4=C3C(OC(C5=CC(OCO6)=C6C(OC)=C5)=C4)=O
TERT-BUTYL P-(BROMOMETHYL) BENZOATE
CAS:108052-76-2
Formula: C12H15BrO2
1.00071e+007
BrCc1ccc(cc1)C(=O)OC(C)(C)C
TERT-BUTYL P-TOLUATE
CAS:13756-42-8
Formula: C12H16O2
1.00071e+007
Cc1ccc(cc1)C(=O)OC(C)(C)C
Tertiapin LQ (trifluoroacetate salt)
Formula: C106H179N33O24S4 • XCF3COOH
37496
[H]N[C@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](CC(N)=O)C(N[C@H](C(N[C@@H](CC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@]([C@H](CC)C)([H])C(N[C@]([C@H](CC)C)([H])C(N[C@]([C@H](CC)C)([H])C(N1CCC[C@H]1C(N[C@@H](CC(C)C)C(N[C@@H](CCC(N)=O)C2=O)=O)=O)=O)=O)=O)=O)=O)=O)CSS
Tertiapin Q (trifluoroacetate salt)
Formula: C106H175N35O24S4 • XCF3COOH
36907
O=C([C@H]1NC([C@@H](NC([C@@H](NC([C@@]2([H])N(CCC2)C([C@](NC([C@](NC([C@](NC([C@@H](NC([C@@H](NC([C@H](CSSC[C@H](NC([C@@H](NC([C@@H](NC3=O)CCCCN)=O)CCCCN)=O)C(NCC(N[C@@H](CCCCN)C(N[C@H](C(N)=O)CCCCN)=O)=O)=O)NC([C@@H](NC([C@H](CSSC1)NC([C@H](CC(C)C)NC([C@
TESAGLITAZAR
CAS:251565-85-2
Formula: C20H24O7S
16791
OC([C@@H](OCC)CC1=CC=C(OCCC2=CC=C(OS(C)(=O)=O)C=C2)C=C1)=O
TESOFENSINE
CAS:195875-84-4
Formula: C17H23Cl2NO
35224
CN1[C@@H]2C[C@H](C3=CC(Cl)=C(Cl)C=C3)[C@@H](COCC)[C@H]1CC2
TESTOSTERONE
CAS:58-22-0
Formula: C19H28O2
15645
O[C@H]1CC[C@@]2([H])[C@]3([H])CCC4=CC(CC[C@]4(C)[C@@]3([H])CC[C@@]21C)=O
TESTOSTERONE ACETATE
CAS:1045-69-8
Formula: C21H30O3
26915
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(C)=O)=C1
TESTOSTERONE CYPIONATE
CAS:58-20-8
Formula: C27H40O3
22543
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCC5CCCC5)=O)=C1
TESTOSTERONE DECANOATE
CAS:5721-91-5
Formula: C29H46O3
22544
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCCCCCCCC)=O)=C1
TESTOSTERONE ENANTHATE
CAS:315-37-7
Formula: C26H40O3
22546
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCCCCC)=O)=C1
TESTOSTERONE HEMISUCCINATE
CAS:521-15-3
Formula: C23H32O5
31716
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCC(O)=O)=O)=C1
TESTOSTERONE ISOCAPROATE
CAS:15262-86-9
Formula: C25H38O3
22547
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCC(C)C)=O)=C1
TESTOSTERONE PHENYLPROPIONATE
CAS:1255-49-8
Formula: C28H36O3
22548
O=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(CCC5=CC=CC=C5)=O)=C1
TESTOSTERONE PROPIONATE
CAS:57-85-2
Formula: C22H32O3
35191
C[C@@]12[C@]3([H])[C@](CCC1=CC(CC2)=O)([H])[C@@]4([H])[C@](CC3)([C@H](CC4)OC(CC)=O)C
TESTOSTERONE-D3
CAS:77546-39-5
Formula: C19H25D3O2
32986
C[C@@]12[C@]3([H])[C@](CCC1=CC(CC2)=O)([H])[C@@]4([H])[C@](CC3)([C@@](C([2H])([2H])C4)([2H])O)C
TETRABENAZINE
CAS:58-46-8
Formula: C19H27NO3
20380
O=C1[C@@H](CC(C)C)CN2[C@@](C(C=C(OC)C(OC)=C3)=C3CC2)([H])C1
TETRABENAZINE-D6
CAS:1392826-25-3
Formula: C19H21D6NO3
26811
O=C1[C@H](CC(C)C)CN2[C@](C(C=C(OC([2H])([2H])[2H])C(OC([2H])([2H])[2H])=C3)=C3CC2)([H])C1
TETRABENAZINE-D7
CAS:2701977-99-1
Formula: C19H20D7NO3
27181
O=C1[C@@H](CC(C([2H])([2H])[2H])([2H])C([2H])([2H])[2H])CN2[C@@](C(C=C(OC)C(OC)=C3)=C3CC2)([H])C1
TETRACHLOROHYDROQUINONE
CAS:87-87-6
Formula: C6H2Cl4O2
23231
OC1=C(Cl)C(Cl)=C(O)C(Cl)=C1Cl
TETRACYCLINE (HYDROCHLORIDE)
CAS:64-75-5
Formula: C22H24N2O8 • HCl
14328
O=C1C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]2([H])C[C@](C3=C(O)[C@@]21O)([H])[C@@](O)(C)C4=CC=CC(O)=C4C3=O.Cl
TETRADECYL PHOSPHONATE
CAS:4671-75-4
Formula: C14H31O3P
1.00076e+007
CCCCCCCCCCCCCCP(=O)(O)O
TETRADECYLPHOSPHOCHOLINE
CAS:77733-28-9
Formula: C19H42NO4P
25700
C[N+](C)(C)CCOP(OCCCCCCCCCCCCCC)([O-])=O
TETRADECYLTRIMETHYLAMMONIUM (BROMIDE)
CAS:1119-97-7
Formula: C17H38N • Br
23248
C[N+](C)(C)CCCCCCCCCCCCCC.[Br-]
TETRAHYDRO-11-DEOXY CORTISOL
CAS:68-60-0
Formula: C21H34O4
26501
O[C@@H]1CC[C@@]2(C)[C@@](CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4(O)C(CO)=O)([H])C1
TETRAHYDROBERBERINE
CAS:522-97-4
Formula: C20H21NO4
33157
COC1=C(CN2CCC3=CC4=C(C=C3C2C5)OCO4)C5=CC=C1OC
TETRAHYDROCOPTISINE
CAS:4312-32-7
Formula: C19H17NO4
34603
C12=CC=C3C(CN4CCC5=CC6=C(C=C5C4C3)OCO6)=C1OCO2
TETRAHYDROCORTISONE
CAS:53-05-4
Formula: C21H32O5
34344
C[C@@]12[C@](CC[C@]2(O)C(CO)=O)([H])[C@@]3([H])[C@@](C(C1)=O)([H])[C@@]4([C@](C[C@@H](CC4)O)([H])CC3)C
TETRAHYDROCURCUMIN
CAS:36062-04-1
Formula: C21H24O6
11757
OC1=C(OC)C=C(CCC(CC(CCC2=CC=C(O)C(OC)=C2)=O)=O)C=C1
TETRAHYDROEPIBERBERINE
CAS:38853-67-7
Formula: C20H21NO4
36177
COC1=C(C=C2C(C3N(CC2)CC4=C5OCOC5=CC=C4C3)=C1)OC
TETRAHYDROFURAN FENTANYL 3-TETRAHYDROFURANCARBOXAMIDE (HYDROCHLORIDE)
CAS:2306827-13-2
Formula: C24H30N2O2 • HCl
22664
O=C(C1CCOC1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=CC=CC=C4.Cl
TETRAHYDROFURAN FENTANYL-D5 (HYDROCHLORIDE)
CAS:2747915-27-9
Formula: C24H25D5N2O2 • HCl
21935
O=C(C1CCCO1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=C([2H])C([2H])=C([2H])C([2H])=C4[2H].Cl
TETRAHYDROHARMINE
CAS:17019-01-1
Formula: C13H16N2O
35037
CC1NCCC2=C1NC3=C2C=CC(OC)=C3
TETRAHYDROHARMINE
CAS:17019-01-1
Formula: C13H16N2O
14449
CC(NCC1)C2=C1C(C=CC(OC)=C3)=C3N2
TETRAHYDROMAGNOLOL
CAS:20601-85-8
Formula: C18H22O2
14234
OC(C=CC(CCC)=C1)=C1C2=CC(CCC)=CC=C2O
TETRAHYDROPIPERINE
CAS:23434-88-0
Formula: C17H23NO3
11758
O=C(CCCCC1=CC(OCO2)=C2C=C1)N3CCCCC3
TETRAHYDROTHIOPHENE FENTANYL
CAS:2748301-41-7
Formula: C24H30N2OS
23399
O=C(C1CCCS1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=CC=CC=C4
TETRAHYDROURIDINE
CAS:18771-50-1
Formula: C9H16N2O6
16402
O[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1N2C(NC(O)CC2)=O
TETRAHYDROXYQUINONE
CAS:319-89-1
Formula: C6H4O6
32908
O=C1C(O)=C(C(C(O)=C1O)=O)O
TETRAHYDROZOLINE (HYDROCHLORIDE)
CAS:522-48-5
Formula: C13H16N2 • HCl
23004
C1(C=CC=C2)=C2C(C3=NCCN3)CCC1.Cl
TETRAMETHYL NORDIHYDROGUAIARETIC ACID
CAS:24150-24-1
Formula: C22H30O4
70302
COc1cc(ccc1OC)CC(C)C(C)Cc1ccc(OC)c(OC)c1
TETRAMETHYLRHODAMINE ETHYL ESTER (PERCHLORATE)
CAS:115532-52-0
Formula: C26H27N2O3 • ClO4
21426
O=C(OCC)C(C=CC=C1)=C1C2=C3C=CC(N(C)C)=CC3=[O+]C4=C2C=CC(N(C)C)=C4.O=Cl(=O)([O-])=O
TETRAMETHYLRHODAMINE ISOTHIOCYANATE (MIXED ISOMERS)
CAS:95197-95-8
Formula: C25H21N3O3S
19593
[O-]C(C(C=C(N=C=S)C=C1)=C1C2=C3C=CC(N(C)C)=CC3=[O+]C4=C2C=CC(N(C)C)=C4)=O.[O-]C(C(C(N=C=S)=CC=C5)=C5C6=C7C=CC(N(C)C)=CC7=[O+]C8=C6C=CC(N(C)C)=C8)=O
TETRAMETHYLRHODAMINE METHYL ESTER (PERCHLORATE)
CAS:115532-50-8
Formula: C25H25N2O3 • ClO4
21437
O=C(OC)C(C=CC=C1)=C1C2=C3C=CC(N(C)C)=CC3=[O+]C4=C2C=CC(N(C)C)=C4.O=Cl(=O)([O-])=O
TETRAMISOLE
CAS:5036-02-2
Formula: C11H12N2S
39242
C12=NC(C3=CC=CC=C3)CN1CCS2
TETRANACTIN
CAS:33956-61-5
Formula: C44H72O12
26687
O=C(O[C@@H](CC)C[C@@]1([H])O[C@]([C@H]2C)([H])CC1)[C@@H](C)[C@]3([H])CC[C@@](C[C@@H](CC)OC([C@@H]([C@]4([H])O[C@@](C[C@@H](OC([C@@H](C)[C@@]5([H])O[C@@](CC5)([H])C[C@@H](CC)OC2=O)=O)CC)([H])CC4)C)=O)([H])O3
TETRANDRINE
CAS:518-34-3
Formula: C38H42N2O6
19874
COC1=C(C2=C(C=C1OC)CCN(C)[C@]2(C3)[H])OC4=CC5=C(C=C4OC)CCN(C)[C@]5(CC6=CC=C(OC7=CC3=CC=C7OC)C=C6)[H]
TETRAZOLIUM (CHLORIDE)
CAS:298-96-4
Formula: C19H15N4 • Cl
17342
C1([N+]2=NC(C3=CC=CC=C3)=NN2C4=CC=CC=C4)=CC=CC=C1.[Cl-]
TETRAZOLYL GLYCINE
CAS:138199-51-6
Formula: C3H5N5O2
28408
OC(C(N)C1=NN=NN1)=O
TETROMYCIN A
CAS:180027-83-2
Formula: C36H48O6
20690
CC1=C[C@@]2([H])[C@@]([C@@](C(C3=C4O)=O)(C)[C@]1([H])/C(C)=C/CC/C(C)=C/[C@@]5(C)[C@@]4(OC3=O)C[C@@H](C)C(C)=C5)([H])[C@@H](C)CC[C@@H]2OC(C)=O
TETROMYCIN B
CAS:180027-84-3
Formula: C34H46O5
23766
CC1=C[C@@]2([H])[C@@]([C@@](C(C3=C4O)=O)(C)[C@]1([H])/C(C)=C/CC/C(C)=C/[C@@]5(C)[C@@]4(OC3=O)C[C@@H](C)C(C)=C5)([H])[C@@H](C)CC[C@@H]2O
TFAP
CAS:1011244-68-0
Formula: C13H10F3N3O
26745
O=C(NC1=CC=C(N)C=N1)C2=CC=C(C(F)(F)F)C=C2
TFB-TBOA (HYDRATE)
Formula: C19H17F3N2O6 • XH2O
31417
FC(F)(F)C1=CC=C(C(NC2=CC=CC(CO[C@H](C(O)=O)[C@H](N)C(O)=O)=C2)=O)C=C1.O
TFC 007
CAS:927878-49-7
Formula: C27H29N5O4
17971
O=C(NC1=CC=C(N2CCC(C(N3CCOCC3)=O)CC2)C=C1)C(C=N4)=CN=C4OC5=CC=CC=C5
TFLLR-NH2 (TRIFLUOROACETATE SALT)
Formula: C31H53N9O6 • XCF3COOH
27548
NC(NCCC[C@@H](C(N)=O)NC([C@@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](N)[C@H](O)C)=O)CC1=CC=CC=C1)=O)=O)CC(C)C)=O)=N.OC(C(F)(F)F)=O
TFMB-R-2-HG
CAS:1445700-01-5
Formula: C13H11F3O4
20461
O=C([C@H]1CCC(O1)=O)OCC2=CC=CC(C(F)(F)F)=C2
TG003
CAS:300801-52-9
Formula: C13H15NO2S
10398
CCN(C1=CC(OC)=CC=C1S/2)C2=C\C(C)=O
TG100713
CAS:925705-73-3
Formula: C12H10N6O
30195
OC1=CC=CC(C2=NC3=C(N=C(N)N=C3N)N=C2)=C1
TG101209
CAS:936091-14-4
Formula: C26H35N7O2S
14696
CC(C)(C)NS(C1=CC=CC(NC2=NC(NC3=CC=C(N4CCN(C)CC4)C=C3)=NC=C2C)=C1)(=O)=O
TG101348
CAS:936091-26-8
Formula: C27H36N6O3S
16289
CC(C)(C)NS(C1=CC=CC(NC2=NC(NC3=CC=C(OCCN4CCCC4)C=C3)=NC=C2C)=C1)(=O)=O
TG11-77 (HYDROCHLORIDE)
CAS:2550393-38-7
Formula: C23H24N6O • HCl
30188
O=C(C1=CN=C(NC2=NC(C)=CC(C)=C2)N=C1)NCCC3=C(C)NC4=C3C=CC=C4.Cl
TG2-179-1
CAS:1135023-19-6
Formula: C22H14ClFN4O2S2
38874
N#CC1=C(NC(CSC2=NN=C(C(C=C3)=CC=C3Cl)O2)=O)SC(C)=C1C(C=C4)=CC=C4F
TG4-155
CAS:1164462-05-8
Formula: C23H26N2O4
17639
COC1=CC(/C=C/C(NCCN2C(C)=CC3=C2C=CC=C3)=O)=CC(OC)=C1OC
TG6-10-1
CAS:1415716-58-3
Formula: C23H23F3N2O4
23444
COC1=CC(/C=C/C(NCCN2C(C(F)(F)F)=CC3=C2C=CC=C3)=O)=CC(OC)=C1OC
TG6-129
CAS:1164464-14-5
Formula: C20H18FN5O3S3
19085
FC1=CC=C(/C=C/C(NC(NC2=CC=C(S(NC3=NN=C(CC)S3)(=O)=O)C=C2)=S)=O)C=C1
TG89
CAS:936091-56-4
Formula: C26H34N6O3S
39162
O=S(NC(C)(C)C)(C1=CC(NC2=NC(NC3=CC=CC(CN4CCOCC4)=C3)=NC=C2C)=CC=C1)=O
TGN 020
CAS:51987-99-6
Formula: C8H6N4OS
30955
O=C(NC1=NN=CS1)C2=CN=CC=C2
TGR-1202
CAS:1532533-67-7
Formula: C31H24F3N5O3
32877
C[C@@H](C1=C(C2=CC(F)=CC=C2)C(C3=CC(F)=CC=C3O1)=O)N4N=C(C5=CC=C(OC(C)C)C(F)=C5)C6=C(N)N=CN=C46
TGR5 RECEPTOR AGONIST
CAS:1197300-24-5
Formula: C18H14Cl2N2O2
16291
ClC1=C(C2=NOC(C)=C2C(N(C3=CC=C(Cl)C=C3)C)=O)C=CC=C1
TGX-221
CAS:663619-89-4
Formula: C21H24N4O2
1.00073e+007
CC(C=C1C(NC2=CC=CC=C2)C)=CN3C1=NC(N4CCOCC4)=CC3=O
TH-1760
CAS:2567914-01-4
Formula: C20H18N4O5S
40469
O=C1OC2=CC(S(=O)(N3CCN(CC3)C(C4=CC=C5NC=CC5=C4)=O)=O)=CC=C2N1
TH-302
CAS:918633-87-1
Formula: C9H16Br2N5O4P
22195
BrCCNP(OCC1=CN=C([N+]([O-])=O)N1C)(NCCBr)=O
TH1020
CAS:1841460-82-9
Formula: C23H15N7S2
33553
C1(C2=CC=NC=C2)=NN=C(SC3=C4C(C5=CC=CN=C5S4)=NC=N3)N1CC6=CC=CC=C6
TH263
CAS:313520-94-4
Formula: C21H20N2O3S
37295
O=C(C1=CC=C(S(=O)(NCC2=CC=CC=C2)=O)C=C1)NCC3=CC=CC=C3
TH287
CAS:1609960-30-6
Formula: C11H10Cl2N4
18132
CNC1=CC(C2=CC=CC(Cl)=C2Cl)=NC(N)=N1
TH588
CAS:1609960-31-7
Formula: C13H12Cl2N4
18133
NC1=NC(NC2CC2)=CC(C3=CC=CC(Cl)=C3Cl)=N1
THAL-SNS-032
CAS:2139287-33-3
Formula: C40H52N8O10S2
40958
O=C(C1=C2C=CC=C1NCCOCCOCCOCCNC(CN3CCC(CC3)C(NC4=NC=C(SCC5=NC=C(C(C)(C)C)O5)S4)=O)=O)N(C(C(N6)=O)CCC6=O)C2=O
THALLOS AM
CAS:1802991-71-4
Formula: C42H36N2O17
35755
O=C(C)OC1=CC=C2C3(C(C=CC(C(N([H])C4=CC(OC)=C(N(CC(OCOC(C)=O)=O)CC(OCOC(C)=O)=O)C=C4)=O)=C5)=C5C(O3)=O)C6=CC=C(OC(C)=O)C=C6OC2=C1
THAPSIGARGIN
CAS:67526-95-8
Formula: C34H50O12
10522
C[C@]1(OC(C)=O)C[C@H](OC(CCC)=O)[C@@]2(O)[C@](OC([C@@]2(C)O)=O)([H])C3=C(C)[C@H](OC(/C(C)=C\C)=O)[C@@H](OC(CCCCCCC)=O)C13
THAXTOMIN A
CAS:122380-18-1
Formula: C22H22N4O6
15601
O=C(N(C)[C@H]1CC2=CNC3=C2C([N+]([O-])=O)=CC=C3)[C@@](CC4=CC=CC(O)=C4)(O)N(C)C1=O
THCA-A
CAS:23978-85-0
Formula: C22H30O4
33448
[H][C@]12C3=C(C=C(CCCCC)C(C(O)=O)=C3O)OC(C)(C)[C@]1([H])CCC(C)=C2
THEACRINE
CAS:2309-49-1
Formula: C9H12N4O3
26855
O=C1C2=C(N(C)C(N2C)=O)N(C)C(N1C)=O
THEAFLAVIN
CAS:4670-05-7
Formula: C29H24O12
25129
O=C1C2=C(O)C(O)=CC([C@@H]3[C@H](O)CC(C(O)=CC(O)=C4)=C4O3)=C2C=C([C@H]5OC(C=C(O)C=C6O)=C6C[C@H]5O)C=C1O
THEAFLAVIN 3,3'-DIGALLATE
CAS:30462-35-2
Formula: C43H32O20
25215
O=C1C2=C(O)C(O)=CC([C@@H]3[C@H](OC(C4=CC(O)=C(O)C(O)=C4)=O)CC(C(O)=CC(O)=C5)=C5O3)=C2C=C([C@H]6OC(C=C(O)C=C7O)=C7C[C@H]6OC(C8=CC(O)=C(O)C(O)=C8)=O)C=C1O
THEAFLAVIN-3-GALLATE
CAS:30462-34-1
Formula: C36H28O16
31510
OC1=C2C(C=C([C@]3([H])[C@@H](CC4=C(O)C=C(O)C=C4O3)OC(C5=CC(O)=C(C(O)=C5)O)=O)C=C(C2=O)O)=C([C@@]6([H])OC7=CC(O)=CC(O)=C7C[C@H]6O)C=C1O
THEOBROMINE
CAS:83-67-0
Formula: C7H8N4O2
21745
O=C(C(N(C)C=N1)=C1N2C)NC2=O
THEOBROMINE-D6
CAS:117490-40-1
Formula: C7H2D6N4O2
9.00357e+006
O=C(C(N(C([2H])([2H])[2H])C=N1)=C1N2C([2H])([2H])[2H])NC2=O
THERMOPSINE
CAS:486-90-8
Formula: C15H20N2O
33853
O=C1N(C2=CC=C1)C[C@]3([H])[C@]4([H])CCCCN4C[C@@]2([H])C3
THIABENDAZOLE
CAS:148-79-8
Formula: C10H7N3S
23391
C12=CC=CC=C1NC(C3=CSC=N3)=N2
THIACLOPRID-D4
CAS:1793071-39-2
Formula: C10H5ClD4N4S
39573
ClC(C=C1)=NC=C1CN2C([2H])([2H])C([2H])([2H])SC2=NC#N
THIAMET G
CAS:1009816-48-1
Formula: C9H16N2O4S
13237
[H][C@@]12[C@@](N=C(N(CC)[H])S2)([H])[C@@H](O)[C@H](O)[C@@H](CO)O1
THIAMETHOXAM
CAS:153719-23-4
Formula: C8H10ClN5O3S
25784
CN1COCN(CC2=CN=C(Cl)S2)/C1=N/[N+]([O-])=O
THIAMETHOXAM-D3
CAS:1294048-82-0
Formula: C8H7ClD3N5O3S
35685
O=[N](/N=C1N(COCN\1C([2H])([2H])[2H])CC(S2)=CN=C2Cl)=O
THIAMINE (HYDROCHLORIDE)
CAS:67-03-8
Formula: C12H17N4OS • Cl [HCl]
25656
CC1=NC(N)=C(C[N+]2=CSC(CCO)=C2C)C=N1.[Cl-].Cl
THIAMINE (NITRATE)
CAS:532-43-4
Formula: C12H17N4OS • NO3
25332
CC1=NC(N)=C(C[N+]2=CSC(CCO)=C2C)C=N1.[O-][N+]([O-])=O
THIAMINE PYROPHOSPHATE (CHLORIDE)
CAS:154-87-0
Formula: C12H19N4O7P2S • Cl
20254
CC1=NC(N)=C(C[N+]2=CSC(CCOP(OP(O)(O)=O)(O)=O)=C2C)C=N1.[Cl-]
THIAMPHENICOL
CAS:15318-45-3
Formula: C12H15Cl2NO5S
21357
CS(C1=CC=C([C@@H](O)[C@H](NC(C(Cl)Cl)=O)CO)C=C1)(=O)=O
THIAZOVIVIN
CAS:1226056-71-8
Formula: C15H13N5OS
14245
O=C(NCC1=CC=CC=C1)C2=CSC(NC3=CC=NC=N3)=N2
THIDIAZURON
CAS:51707-55-2
Formula: C9H8N4OS
17272
O=C(NC1=CN=NS1)NC2=CC=CC=C2
THIELAVIN A
CAS:71950-66-8
Formula: C29H30O10
21767
CC1=C(O)C=C(C)C(C(OC2=C(C)C(C)=C(C(OC3=C(C)C(C)=C(C(O)=O)C(O)=C3C)=O)C(O)=C2C)=O)=C1O
THIELAVIN B
CAS:71950-67-9
Formula: C31H34O10
18770
OC1=C(C)C(O)=C(C(OC2=C(C)C(C)=C(C(OC3=C(C)C(C)=C(C(O)=O)C(OC)=C3C)=O)C(OC)=C2C)=O)C(C)=C1
THIO-MILTEFOSINE
CAS:943022-11-5
Formula: C21H46NO3PS
1.00098e+007
CCCCCCCCCCCCCCCCSP(=O)(O)OCC[N](C)(C)C
THIO-NAD
CAS:4090-29-3
Formula: C21H27N7O13P2S
36466
O=P(OP(OC[C@@H]1[C@@H](O)[C@@H](O)[C@@]([N+]2=CC=CC(C(N)=S)=C2)([H])O1)([O-])=O)(O)OC[C@@H]3[C@@H](O)[C@@H](O)[C@]([H])(N4C=NC5=C(N)N=CN=C54)O3
THIO-P-TOLUAMIDE
CAS:2362-62-1
Formula: C8H9NS
13229
CC1=CC=C(C(N)=S)C=C1
THIOACETAZONE
CAS:104-06-3
Formula: C10H12N4OS
34589
O=C(C)NC1=CC=C(C=C1)C=NNC(N)=S
THIOARGININE (HYDROBROMIDE)
CAS:2108196-23-0
Formula: C6H13N3O2S • HBr
80240
N/C(SCCC[C@H](N)C(O)=O)=N/[H].Br
THIOCARLIDE
CAS:910-86-1
Formula: C23H32N2O2S
1.0007e+007
CC(C)CCOc1ccc(cc1)NC(=S)Nc1ccc(OCCC(C)C)cc1
THIOCILLIN I
CAS:59979-01-0
Formula: C48H49N13O10S6
26681
O=C(C1=CSC(C2=CSC(C3=NC(C4=CSC([C@H]([C@H](O)C)NC(C5=CSC6=N5)=O)=N4)=C(C7=NC(C(N[C@]([C@H](O)C)([H])C(N/C(C8=NC(C(N[C@H]6C(C)(O)C)=O)=CS8)=C\C)=O)=O)=CS7)C=C3)=N2)=N1)N/C(C(NC[C@H](O)C)=O)=C\C
THIOCORALINE
CAS:173046-02-1
Formula: C48H56N10O12S6
29509
O=C([C@H](CSC)N(C([C@H]1N(C)C(CNC([C@H](NC(C2=NC(C=CC=C3)=C3C=C2O)=O)CSC([C@H](CSC)N(C)C([C@H](CSSC1)N4C)=O)=O)=O)=O)=O)C)SC[C@@H](NC(C5=NC(C=CC=C6)=C6C=C5O)=O)C(NCC4=O)=O
THIODIGALACTOSIDE
CAS:51555-87-4
Formula: C12H22O10S
17154
O[C@@H]1[C@H](O)[C@@H](O)[C@H](S[C@@]2([H])[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O2)O[C@@H]1CO
THIODIGLYCOLIC ACID-D4
CAS:132090-51-8
Formula: C4H2D4O4S
9.00248e+006
OC(C([2H])([2H])SC([2H])([2H])C(O)=O)=O
THIOFENTANYL (HYDROCHLORIDE)
CAS:79278-88-9
Formula: C20H26N2OS • HCl
20786
O=C(N(C1=CC=CC=C1)C2CCN(CCC3=CC=CS3)CC2)CC.Cl
THIOFLUOR 623
CAS:1004324-99-5
Formula: C31H30N6O10S
13083
COCCOCCOCCN(c1ccc(cc1)\C=C/C1=C(CN)C(=C(CN)CN)OC1(C)C)S(=O)(=O)c1ccc(cc1[N](=O)O)[N](=O)O
THIOGLO1
CAS:137350-66-4
Formula: C20H13NO7
13235
COC1=CC=C(C=CC(O2)=C3C=C(C(OC)=O)C2=O)C3=C1N4C(C=CC4=O)=O
THIOLOX
CAS:1202193-89-2
Formula: C15H18N2OS
38946
O=C(NCCCC)C1=C(N)SC(C2=CC=CC=C2)=C1
THIOMUSCIMOL
CAS:62020-54-6
Formula: C4H6N2OS
18857
O=C1C=C(CN)SN1
THIOMYRISTOYL
CAS:1429749-41-6
Formula: C34H51N3O3S
19398
O=C(N[C@@H](CCCCNC(CCCCCCCCCCCCC)=S)C(NC1=CC=CC=C1)=O)OCC2=CC=CC=C2
THIONORDIAZEPAM
CAS:4547-02-8
Formula: C15H11ClN2S
21988
ClC1=CC=C(C2=C1)NC(CN=C2C3=CC=CC=C3)=S
THIOPERAMIDE (MALEATE)
CAS:148440-81-7
Formula: C15H24N4S • C4H4O4
1.00111e+007
S=C(NC1CCCCC1)N(CC2)CCC2C3=CN=CN3.O=C(/C=C\C(O)=O)O
THIOPHANATE-METHYL
CAS:23564-05-8
Formula: C12H14N4O4S2
35402
O=C(NC(NC1=C(NC(NC(OC)=O)=S)C=CC=C1)=S)OC
THIOPHENE FENTANYL (HYDROCHLORIDE)
CAS:2306823-39-0
Formula: C24H26N2OS • HCl
22802
O=C(C1=CC=CS1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=CC=CC=C4.Cl
THIOPHENE FENTANYL 3-THIOPHENECARBOXAMIDE (HYDROCHLORIDE)
CAS:2748624-69-1
Formula: C24H26N2OS • HCl
23009
O=C(C1=CSC=C1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=CC=CC=C4.Cl
THIOPHENE FENTANYL-D5 (HYDROCHLORIDE)
CAS:2747914-12-9
Formula: C24H21D5N2OS • HCl
25135
O=C(C1=CC=CS1)N(C2CCN(CCC3=CC=CC=C3)CC2)C4=C([2H])C([2H])=C([2H])C([2H])=C4[2H].Cl
THIOPHENE-2-AMIDOXIME
CAS:108443-93-2
Formula: C5H6N2OS
11061
N/C(C1=CC=CS1)=N\O
THIOPROPAMINE (HYDROCHLORIDE)
CAS:53632-92-1
Formula: C7H11NS • HCl
9.00204e+006
CC(N)CC1=CC=CS1.Cl
Thioredoxin Reductase 1 Inhibitor 1
CAS:246020-68-8
Formula: C12H9ClN2O5S
31307
COC1=CC=C([N+]([O-])=O)C(S(C2=CC=C(Cl)C=C2)(=O)=O)=N1
THIORIDAZINE (HYDROCHLORIDE)
CAS:130-61-0
Formula: C21H26N2S2 • HCl
14400
CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCC4N(C)CCCC4.Cl
THIORIDAZINE-D3 (HYDROCHLORIDE)
CAS:1189928-36-6
Formula: C21H23D3N2S2 • HCl
30239
CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCC4N(C([2H])([2H])[2H])CCCC4.Cl
THIORPHAN
CAS:76721-89-6
Formula: C12H15NO3S
15600
O=C(NCC(O)=O)C(CS)CC1=CC=CC=C1
THIORPHAN-D5
CAS:2183240-70-0
Formula: C12H10D5NO3S
28692
O=C(NCC(O)=O)C(CS)CC1=C([2H])C([2H])=C([2H])C([2H])=C1[2H]
THIOSILDENAFIL
CAS:479073-79-5
Formula: C22H30N6O3S2
13939
S=C1C2=C(C(CCC)=NN2C)N=C(C3=C(OCC)C=CC(S(=O)(N4CCN(C)CC4)=O)=C3)N1
THIOSTREPTON
CAS:1393-48-2
Formula: C72H85N19O18S5
19200
O=C([C@@H](NC(C(NC([C@@H](NC([C@@H](N[C@H](C=C1)[C@]2([H])O)[C@@H](C)CC)=O)C)=O)=C)=O)C)N[C@](C3=NC(C(N[C@H](C(N/C(C4=N[C@]5([H])CS4)=C\C)=O)[C@H](O)C)=O)=CS3)(CCC(C6=NC(C(NC(C(NC(C(N)=O)=C)=O)=C)=O)=CS6)=N7)[C@@]7([H])C8=CSC([C@@]([C@H](OC(C9=CC([C@@H](O
THIOTHIXENE
CAS:5591-45-7
Formula: C23H29N3O2S2
23649
CN1CCN(CC/C=C2C(C=CC=C3)=C3SC4=C\2C=C(S(N(C)C)(=O)=O)C=C4)CC1
THJ
CAS:2180931-94-4
Formula: C22H22N4O
14889
O=C(NC1=C(N=CC=C2)C2=CC=C1)C3=NN(CCCCC)C4=C3C=CC=C4
THJ 018
CAS:1364933-55-0
Formula: C23H22N2O
11962
O=C(C1=NN(CCCCC)C2=C1C=CC=C2)C3=C4C(C=CC=C4)=CC=C3
THJ2201
CAS:1801552-01-1
Formula: C23H21FN2O
14789
O=C(C1=CC=CC2=C1C=CC=C2)C3=NN(CCCCCF)C4=C3C=CC=C4
THJ2201 N-(5-hydroxypentyl) metabolite
CAS:1850409-16-3
Formula: C23H22N2O2
9.00374e+006
O=C(C1=CC=CC2=C1C=CC=C2)C3=NN(CCCCCO)C4=C3C=CC=C4
THONZONIUM (BROMIDE)
CAS:553-08-2
Formula: C32H55N4O • Br
31253
C[N+](C)(CCN(C1=NC=CC=N1)CC2=CC=C(OC)C=C2)CCCCCCCCCCCCCCCC.[Br-]
THPP-1
CAS:1257051-63-0
Formula: C23H21ClN6O3
34219
O=C(N1CC2=C(OCCOC)N=C(C3=CN=C(Cl)C=C3)N=C2CC1)C4=C5C=CC=CN5C=N4
THPTA
CAS:760952-88-3
Formula: C18H30N10O3
35670
OCCCN1C=C(N=N1)CN(CC(N=N2)=CN2CCCO)CC(N=N3)=CN3CCCO
THROMBIN RECEPTOR AGONIST PEPTIDE (TRIFLUOROACETATE SALT)
Formula: C81H118N20O23 • XCF3COOH
24710
[H]N[C@@H](CO)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(N)=O)C(N1CCC[C@H]1C(N[C@@H](CC(N)=O)C(N[C@H](C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CCC(O)=O)C(N2CCC[C@H]2C(N[C@H](C(O)=O)CC3=CC=CC=C3)=O)=O)=O)CC4=CC=C(O)C=C4)=O)=O)CC
THROMBIN RECEPTOR PEPTIDE LIGAND (TRIFLUOROACETATE SALT)
Formula: C33H54N10O8 • XCF3COOH
24995
N[C@@H](C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@H](C(N[C@@H](C)C(N[C@H](C(N[C@@H](C)C(N[C@@H](C)C(O)=O)=O)=O)CCCNC(N)=N)=O)=O)CC(C)C)=O)=O.FC(F)(C(O)=O)F
THROMBOXANE B2
CAS:54397-85-2
Formula: C20H34O6
19030
O[C@@H]1[C@H](C/C=C\CCCC(O)=O)[C@@H](/C=C/[C@@H](O)CCCCC)OC(O)C1
THROMBOXANE B2-D9
Formula: C20H25D9O6
9.00256e+006
O[C@@H]1[C@H](C/C=C\CCCC(O)=O)[C@@H](/C=C/[C@@H](O)CC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])OC(O)C1
THYMIDINE
CAS:50-89-5
Formula: C10H14N2O5
20519
CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)C2)C(NC1=O)=O
Thymidine-5'-O-(a,ß-methylene)diphosphate (sodium salt)
CAS:71370-60-0
Formula: C11H15N2O10P2 • 3Na
38571
CC(C(NC1=O)=O)=CN1[C@H]2C[C@H](O)[C@@H](COP(CP([O-])([O-])=O)([O-])=O)O2.[Na+].[Na+].[Na+]
THYMIDINE-D4
CAS:347841-67-2
Formula: C10H10D4N2O5
36322
OC[C@H]1O[C@](N2C(NC(C(C([2H])([2H])[2H])=C2[2H])=O)=O)([H])C[C@@H]1O
THYMINE
CAS:65-71-4
Formula: C5H6N2O2
38749
O=C1NC=C(C)C(N1)=O
Thymine-13C5,15N2
CAS:2483830-13-1
Formula: [13C]5H6[15N]2O2
41172
O=[13C]([15NH][13CH]=[13C]1[13CH3])[15NH][13C]1=O
THYMINE-D4
CAS:156054-85-2
Formula: C5H2D4N2O2
36329
O=C1C(C([2H])([2H])[2H])=C([2H])NC(N1)=O
THYMOHYDROQUINONE
CAS:2217-60-9
Formula: C10H14O2
27558
CC(C)C1=C(O)C=C(C)C(O)=C1
THYMOPENTIN
CAS:69558-55-0
Formula: C30H49N9O9
30119
NC(NCCC[C@H](N)C(N[C@@H](CCCCN)C(N[C@@H](CC(O)=O)C(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)=O)=O)=O)=O)=N
THYMOQUINONE
CAS:490-91-5
Formula: C10H12O2
15039
O=C(C(C(C)C)=C1)C=C(C)C1=O
THYMOSIN A1 (HUMAN, MOUSE, RAT, BOVINE)
CAS:62304-98-7
Formula: C129H215N33O55
28748
O=C(N[C@@H](CO)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](C(C)C)C(N[C@H](C(N[C@]([C@@H](C)O)([H])C(N[C@@H](CO)C(N[C@@H](CO)C(N[C@@H](CCC(O)=O)C(N[C@]([C@H](CC)C)([H])C(N[C@]([C@@H](C)O)([H])C(N[C@]([C@@H](C)O)([H])C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C
Thymosin ß4 (human, mouse, rat, porcine, bovine) (acetate)
Formula: C212H350N56O78S • XC2H4O2
28605
O=C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CCCCN)C(N1CCC[C@H]1C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCC(O)=O)C(N[C@]([C@H](CC)C)([H])C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCCN)C(N[C@H](C(N[C@H](C(N[C@@H](CCCCN)C(N[C@@H](CO)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@@H](CCCCN)C
THYMULIN (ACETATE HYDRATE)
Formula: C33H54N12O15 • XC2H4O2 [XH2O]
33418
NC(C[C@@H](C(O)=O)NC([C@H](CO)NC(CNC(CNC([C@H](CCC(N)=O)NC([C@H](CO)NC([C@H](CCCCN)NC([C@H](C)NC([C@@H]1CCC(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.OC(C)=O.O
THYROID HORMONE RECEPTOR ANTAGONIST (1-850)
CAS:251310-57-3
Formula: C21H20F3N5O4
17248
O=C(NNC(/C=C1CCN(C2=CC=C([N+]([O-])=O)C=C2)CC/1)=O)NC3=CC(C(F)(F)F)=CC=C3
THYROTROPIN-RELEASING HORMONE
CAS:24305-27-9
Formula: C16H22N6O4
22917
O=C(N1CCC[C@H]1C(N)=O)[C@H](CC2=CNC=N2)NC([C@@H]3CCC(N3)=O)=O
THZ1
CAS:1604810-83-4
Formula: C31H28ClN7O2
9.00222e+006
CN(C/C=C/C(NC1=CC=C(C(NC2=CC(NC3=NC=C(Cl)C(C4=CNC5=C4C=CC=C5)=N3)=CC=C2)=O)C=C1)=O)C
THZ1-R
CAS:1621523-07-6
Formula: C31H30ClN7O2
31054
CN(C)CCCC(NC1=CC=C(C(NC2=CC(NC3=NC(C4=CNC5=CC=CC=C54)=C(Cl)C=N3)=CC=C2)=O)C=C1)=O
THZ2
CAS:1604810-84-5
Formula: C31H28ClN7O2
31055
CN(C)C/C=C/C(NC1=CC(C(NC2=CC(NC3=NC(C4=CNC5=CC=CC=C54)=C(Cl)C=N3)=CC=C2)=O)=CC=C1)=O
THZ531
CAS:1702809-17-3
Formula: C30H32ClN7O2
26386
ClC1=CN=C(N[C@@H]2CCCN(C(C3=CC=C(NC(/C=C/CN(C)C)=O)C=C3)=O)C2)N=C1C4=CNC5=C4C=CC=C5
TIAGABINE (HYDROCHLORIDE)
CAS:145821-59-6
Formula: C20H25NO2S2 • HCl
22926
OC([C@@H]1CCCN(CC/C=C(C2=C(C)C=CS2)\C3=C(C)C=CS3)C1)=O.Cl
TIAGABINE-D6 (HYDROCHLORIDE)
CAS:1217808-68-8
Formula: C20H19D6NO2S2 • HCl
30766
OC([C@@H]1CCCN(CC/C=C(C2=C(C([2H])([2H])[2H])C=CS2)\C3=C(C([2H])([2H])[2H])C=CS3)C1)=O.Cl
Tiamulin (fumarate)
CAS:55297-96-6
Formula: C28H47NO4S • C4H4O4
21216
O=C1CC[C@@]2(CC[C@H]3C)[C@@H](C)[C@H](O)[C@@](C=C)(C)C[C@@H](OC(CSCCN(CC)CC)=O)[C@@]3(C)[C@@]21[H].OC(/C=C/C(O)=O)=O
TIAMULIN-D10 (HYDROCHLORIDE)
CAS:2750534-93-9
Formula: C28H37D10NO4S • HCl
29580
O=C1CC[C@@]2(CC[C@H]3C)[C@@H](C)[C@H](O)[C@@](C=C)(C)C[C@@H](OC(CSCCN(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])[2H])=O)[C@@]3(C)[C@@]21[H].Cl
TIANEPTINE (SODIUM SALT)
CAS:30123-17-2
Formula: C21H24ClN2O4S • Na
17561
[O-]C(CCCCCCNC(C1=C2C=C(Cl)C=C1)C(C=CC=C3)=C3N(C)S2(=O)=O)=O.[Na+]
TIANEPTINE (SODIUM SALT)
CAS:30123-17-2
Formula: C21H24ClN2O4S • Na
25950
[O-]C(CCCCCCNC(C1=C2C=C(Cl)C=C1)C(C=CC=C3)=C3N(C)S2(=O)=O)=O.[Na+]
TIANEPTINE METABOLITE MC5 (SODIUM SALT)
CAS:115220-11-6
Formula: C19H20ClN2O4S • Na
36694
O=C(CCCCNC1C2=C(N(S(=O)(C3=CC(Cl)=CC=C31)=O)C)C=CC=C2)[O-].[Na+]
TIANEPTINE-D6 (HYDROCHLORIDE)
Formula: C21H19ClD6N2O4S • HCl
36800
OC(CCC([2H])([2H])C([2H])([2H])C([2H])([2H])CNC(C1=C2C=C(Cl)C=C1)C(C=CC=C3)=C3N(C)S2(=O)=O)=O.Cl
TIBOLONE
CAS:5630-53-5
Formula: C21H28O2
1.00063e+007
O[C@@]1(C#C)CC[C@@]2([H])[C@]([C@]3([H])CC[C@@]21C)([H])[C@H](C)CC4=C3CCC(C4)=O
TIC10
CAS:1616632-77-9
Formula: C24H26N4O
16109
CC1=CC=CC=C1CN(C2=O)C3=NCCN3C4=C2CN(CC5=CC=CC=C5)CC4
TICAGRELOR
CAS:274693-27-5
Formula: C23H28F2N6O4S
15425
FC(C(F)=C1)=CC=C1[C@@H]2C[C@H]2NC3=C4C(N([C@@H]5C[C@H](OCCO)[C@@H](O)[C@H]5O)N=N4)=NC(SCCC)=N3
TICAGRELOR-D7
CAS:1265911-55-4
Formula: C23H21D7F2N6O4S
25027
FC(C(F)=C1)=CC=C1[C@@H]2C[C@H]2NC3=C4C(N([C@@H]5C[C@H](OCCO)[C@@H](O)[C@H]5O)N=N4)=NC(SC([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])=N3
TICARCILLIN (SODIUM SALT)
CAS:4697-14-7
Formula: C15H14N2O6S2 • 2Na
26065
CC1(C)[C@H](C([O-])=O)N2C([C@@H](NC(C(C([O-])=O)C3=CSC=C3)=O)[C@@]2([H])S1)=O.[Na+].[Na+]
TICLOPIDINE (HYDROCHLORIDE)
CAS:53885-35-1
Formula: C14H14CLNS • HCL
20770
ClC1=C(CN2CCC(SC=C3)=C3C2)C=CC=C1.Cl
TICLOPIDINE-D4 (HYDROCHLORIDE)
CAS:2932627-17-1
Formula: C14H10ClD4NS • HCl
33467
ClC(C([2H])=C([2H])C([2H])=C1[2H])=C1CN2CC3=C(SC=C3)CC2.Cl
TIDEGLUSIB
CAS:865854-05-3
Formula: C19H14N2O2S
16727
O=C(N(CC1=CC=CC=C1)C2=O)SN2C3=C4C(C=CC=C4)=CC=C3
TIE2 INHIBITOR 7
CAS:1020412-97-8
Formula: C31H35N3O5
19535
CC1=CC=C(C=C1)OC(N(CC(N[C@H](C2CCCCC2)C)=O)CC3=CC=C(C=C3)C4=CC(C(O)=O)=CN=C4)=O
TIE2 KINASE INHIBITOR
CAS:948557-43-5
Formula: C26H21N3O2S
17858
COC1=CC2=C(C=C1)C=C(C3=C(C4=CC=NC=C4)N=C(C5=CC=C(S(C)=O)C=C5)N3)C=C2
TIENILIC ACID
CAS:40180-04-9
Formula: C13H8Cl2O4S
1.00085e+007
O=C(C1=C(Cl)C(Cl)=C(OCC(O)=O)C=C1)C2=CC=CS2
TIGECYCLINE
CAS:220620-09-7
Formula: C29H39N5O8
15026
OC1=C(C(C2=C(O)[C@@](C(C(C(N)=O)=C(O)[C@H]3N(C)C)=O)(O)[C@@]3([H])C[C@]2([H])C4)=O)C4=C(N(C)C)C=C1NC(CNC(C)(C)C)=O
TIGECYCLINE-D9
CAS:2699607-86-6
Formula: C29H30D9N5O8
25414
OC1=C(C(C2=C(O)[C@@](C(C(C(N)=O)=C(O)[C@H]3N(C)C)=O)(O)[C@@]3([H])C[C@]2([H])C4)=O)C4=C(N(C)C)C=C1NC(CNC(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])=O
Tiger17 (trifluoroacetate salt)
Formula: C62H97N21O11S2 • XCF3COOH
37473
O=C(N[C@H](C(N1[C@](CCC1)([H])C(N[C@H](C(N2[C@](CCC2)([H])C(N[C@H](C(N3[C@](CCC3)([H])C(N[C@H](C(N[C@@H](CSSC4)C(N[C@H](C(N)=O)CC5=CN=CN5)=O)=O)CCCNC(N)=N)=O)=O)CCCCN)=O)=O)CCCCN)=O)=O)CCCCN)[C@H]4NC([C@@H](N)CC6=CNC7=CC=CC=C67)=O.OC(C(F)(F)F)=O
TIGLOYL FENTANYL
Formula: C24H30N2O
26261
O=C(/C(C)=C/C)N(C1CCN(CCC2=CC=CC=C2)CC1)C3=CC=CC=C3
Tigloyl-L-carnitine (chloride)
Formula: C12H22NO4 • Cl
30994
OC(C[C@H](C[N+](C)(C)C)OC(/C(C)=C/C)=O)=O.[Cl-]
TIGOGENIN
CAS:77-60-1
Formula: C27H44O3
30137
O[C@H]1CC[C@@]2(C)[C@](CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])C[C@@]5([H])[C@]4([H])[C@H](C)[C@]6(OC[C@H](C)CC6)O5)([H])C1
TILDIPIROSIN
CAS:328898-40-4
Formula: C41H71N3O8
17089
CC1=C/[C@@H]([C@H](OC(C[C@H]([C@@H]([C@H]([C@H](C[C@H](C(/C=C/1)=O)C)CCN2CCCCC2)O[C@@]3(O[C@@H]([C@H]([C@@H]([C@H]3O)N(C)C)O)C)[H])C)O)=O)CC)CN4CCCCC4
TILETAMINE (HYDROCHLORIDE)
CAS:14176-50-2
Formula: C12H17NOS • HCl
19794
O=C1CCCCC1(C2=CC=CS2)NCC.Cl
TILFRINIB
CAS:1600515-49-8
Formula: C17H13N3O
25647
OC1=CC=CC(NC2=CC=NC3=C2C4=C(C=CC=C4)N3)=C1
TILIROSIDE
CAS:20316-62-5
Formula: C30H26O13
34493
O=C(C(O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(/C=C/C2=CC=C(C=C2)O)=O)=C(C3=CC=C(C=C3)O)OC4=CC(O)=C5)C4=C5O
TILMICOSIN (PHOSPHATE)
CAS:137330-13-3
Formula: C46H80N2O13 • H3PO4
18190
CC[C@@H](OC(C[C@@H](O)[C@H](C)[C@@H](O[C@@]1([H])[C@H](O)[C@@H](N(C)C)[C@H](O)[C@@H](C)O1)[C@@H](CCN2C[C@@H](C)C[C@@H](C)C2)C[C@H]3C)=O)[C@@H](CO[C@@H]4O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]4OC)/C=C(C)/C=C/C3=O.O=P(O)(O)O
TILMICOSIN-D3
CAS:2714486-61-8
Formula: C46H77D3N2O13
33545
C[C@@H](C[C@H](C1)C)CN1CC[C@@H](C[C@H](C(/C=C/C(C)=C/[C@@H]([C@H](OC(C[C@H]([C@@H]2C)O)=O)CC)CO[C@H]3[C@@H]([C@@H]([C@@H]([C@H](O3)C)O)OC)OC)=O)C)[C@@H]2O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C)O)N(C)C([2H])([2H])[2H])O
TILORONE (HYDROCHLORIDE)
CAS:27591-69-1
Formula: C25H34N2O3 • 2HCl
17868
CCN(CC)CCOC1=CC=C(C(C=CC(OCCN(CC)CC)=C2)=C2C3=O)C3=C1.Cl.Cl
TIMOLOL (MALEATE)
CAS:26921-17-5
Formula: C13H24N4O3S • C4H4O4
13974
CC(C)(C)NC[C@H](O)COC1=NSN=C1N2CCOCC2.OC(/C=C\C(O)=O)=O
TIMOSAPONIN AI
CAS:68422-00-4
Formula: C33H54O8
36174
C[C@@]12[C@]3([H])[C@@](C[C@@]1([H])[C@@]4([H])[C@]([C@@]5([C@](C[C@H](CC5)O[C@@H]6O[C@@H]([C@@H]([C@@H]([C@H]6O)O)O)CO)([H])CC4)C)([H])CC2)([H])O[C@]7(CC[C@@H](CO7)C)[C@H]3C
TIMOSAPONIN AIII
CAS:41059-79-4
Formula: C39H64O13
22236
O[C@H]([C@H](O)[C@H]1O[C@@]2([H])[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@@H](CO)O[C@@]1([H])O[C@H]3CC[C@@]4(C)[C@@](CC[C@]5([H])[C@]4([H])CC[C@@]6(C)[C@@]5([H])C[C@@]7([H])[C@]6([H])[C@H](C)[C@]8(OC[C@@H](C)CC8)O7)([H])C3
TIMOSAPONIN BII
CAS:136656-07-0
Formula: C45H76O19
30644
C[C@H](CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)CC[C@@]2(O)O[C@@]3([H])C[C@@]4([H])[C@]5([H])CC[C@]6([H])C[C@@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O8)[C@@H](O)[C@@H](O)[C@@H](CO)O7)CC[C@]6(C)[C@@]5([H])CC[C@]4(C)[C@@]3([H])[C@@H]
TIN MESOPORPHYRIN IX (CHLORIDE)
CAS:106344-20-1
Formula: C34H34Cl2N4O4Sn • 2H
19071
[Cl-][Sn+4]1([N-]2C3=CC(C(C)=C4CCC([O-])=O)=[N]1C4=CC5=C6CCC([O-])=O)([N](C7=C8)=C(C(C)=C7CC)C=C2C(CC)=C3C)([N-]5C8=C6C)[Cl-].[H+].[H+]
Tin(IV) Protoporphyrin IX Chloride
CAS:14325-05-4
Formula: C34H30Cl2N4O4Sn • 2H
16375
[O-]C(CCC1=C(C=C2[N]3=C4C(C)=C2CCC([O-])=O)[N-]([Sn+4]35([Cl-])([Cl-])[N]6=C7C=C(C(C=C)=C8C)[N-]5C8=C4)C(C=C6C(C=C)=C7C)=C1C)=O.[H+].[H+]
TINIDAZOLE
CAS:19387-91-8
Formula: C8H13N3O4S
21755
CC1=NC=C([N+]([O-])=O)N1CCS(CC)(=O)=O
TIOCONAZOLE
CAS:65899-73-2
Formula: C16H13Cl3N2OS
26069
ClC1=CC(Cl)=C(C(CN2C=CN=C2)OCC3=C(Cl)SC=C3)C=C1
TIOPRONIN
CAS:1953-02-2
Formula: C5H9NO3S
23720
OC(CNC(C(S)C)=O)=O
Tiopronin-Cysteine Disulfide
CAS:77591-18-5
Formula: C8H14N2O5S2
39020
O=C(C(SSC[C@@H](C(O)=O)N)C)NCC(O)=O
TIOPRONIN-D3
CAS:1189700-74-0
Formula: C5H6D3NO3S
33376
OC(CNC(C(S)C([2H])([2H])[2H])=O)=O
TIOTROPIUM (BROMIDE)
CAS:136310-93-5
Formula: C19H22NO4S2 • Br
15773
O=C(C(C1=CC=CS1)(O)C2=CC=CS2)O[C@H]3C[C@H]4[C@H]5[C@H](O5)[C@H]([N+]4(C)C)C3.[Br-]
TIOTROPIUM-D3 (BROMIDE)
CAS:1127226-56-5
Formula: C19H19D3NO4S2 • Br
25285
O=C(C(C1=CC=CS1)(O)C2=CC=CS2)O[C@H]3C[C@H]4[C@H]5[C@H](O5)[C@H]([N+]4(C([2H])([2H])[2H])C)C3.[Br-]
TIOXOLONE
CAS:4991-65-5
Formula: C7H4O3S
31372
O=C1OC2=CC(O)=CC=C2S1
TIP39 (human, bovine) (trifluoroacetate salt)
Formula: C202H325N61O54S • XCF3COOH
37452
OC(C(F)(F)F)=O.O=C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CC(O)=O)C(N[C@@H](CC(O)=O)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N
TIPIFARNIB
CAS:192185-72-1
Formula: C27H22Cl2N4O
11747
ClC1=CC=CC(C(C2=C3C=CC([C@@](C4=CC=C(Cl)C=C4)(N)C5=CN=CN5C)=C2)=CC(N3C)=O)=C1
TIPIRACIL (HYDROCHLORIDE)
CAS:183204-72-0
Formula: C9H11ClN4O2 • HCl
23319
ClC1=C(CN2CCCC2=N)NC(NC1=O)=O.Cl
TIPLAXTININ
CAS:393105-53-8
Formula: C24H16F3NO4
9.00045e+006
O=C(C(O)=O)C1=CN(CC2=CC=CC=C2)C3=CC=C(C4=CC=C(OC(F)(F)F)C=C4)C=C31
TIPRANAVIR
CAS:174484-41-4
Formula: C31H33F3N2O5S
21028
O=S(C1=NC=C(C(F)(F)F)C=C1)(NC2=CC([C@H](C3=C(O)C[C@@](CCC)(CCC4=CC=CC=C4)OC3=O)CC)=CC=C2)=O
TIPRANAVIR-D4
CAS:1217819-15-2
Formula: C31H29D4F3N2O5S
28907
O=S(C1=NC=C(C(F)(F)F)C=C1)(NC2=CC([C@H](C3=C(O)C[C@@](C([2H])([2H])C([2H])([2H])C)(CCC4=CC=CC=C4)OC3=O)CC)=CC=C2)=O
TIQ-A
CAS:420849-22-5
Formula: C11H7NOS
16112
O=C1NC2=C(C=CS2)C3=C1C=CC=C3
TIRAPAZAMINE
CAS:27314-97-2
Formula: C7H6N4O2
25981
NC1=[N+]([O-])C2=CC=CC=C2[N+]([O-])=N1
TIRASEMTIV
CAS:1005491-05-3
Formula: C12H14N4O
26075
O=C1N(C(CC)CC)C2=NC(C#C)=CN=C2N1
TIRATRICOL
CAS:51-24-1
Formula: C14H9I3O4
28729
OC(CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)=O
TIROFIBAN (HYDROCHLORIDE HYDRATE)
CAS:150915-40-5
Formula: C22H36N2O5S • HCl [H2O]
23392
O=C(O)[C@@H](NS(CCCC)(=O)=O)CC1=CC=C(OCCCCC2CCNCC2)C=C1.Cl.O
TIRUCALLOL
CAS:514-46-5
Formula: C30H50O
35623
C[C@@]12C3=C(CC[C@]1([C@](CC2)([H])[C@@H](C)CC/C=C(C)\C)C)[C@@]4([C@@](C(C)([C@H](CC4)O)C)([H])CC3)C
Tirzepatide (sodium salt)
Formula: C225H348N48O68 • XNa
39748
OC[C@@H](C(N)=O)NC([C@H]1N(C([C@H]2N(C([C@H]3N(C([C@H](C)NC(CNC([C@H](CO)NC([C@H](CO)NC([C@H]4N(C(CNC(CNC([C@H](C)NC([C@H]([C@@H](C)CC)NC([C@H](CC(C)C)NC([C@H](CC5=CNC6=C5C=CC=C6)NC([C@H](CCC(N)=O)NC([C@H](C(C)C)NC([C@H](CC7=CC=CC=C7)NC([C@H](C)NC([C@H](C
TIVANTINIB
CAS:905854-02-6
Formula: C23H19N3O2
17135
O=C(N1)[C@@H](C2=CNC3=C2C=CC=C3)[C@H](C4=CN5C6=C4C=CC=C6CCC5)C1=O
TIVOZANIB (HYDRATE)
CAS:682745-40-0
Formula: C22H19ClN4O5 • H2O
18493
COC1=C(OC)C=C(C(OC2=CC(Cl)=C(NC(NC3=NOC(C)=C3)=O)C=C2)=CC=N4)C4=C1.O
TIZANIDINE (HYDROCHLORIDE)
CAS:64461-82-1
Formula: C9H8ClN5S • HCl
38559
ClC1=C(NC2=NCCN2)C3=NSN=C3C=C1.Cl
TIZANIDINE (HYDROCHLORIDE)
CAS:64461-82-1
Formula: C9H8N5ClS • HCl
16477
ClC1=C(NC2=NCCN2)C3=NSN=C3C=C1.Cl
TIZANIDINE-D4 (HYDROCHLORIDE)
CAS:1188263-51-5
Formula: C9H4ClD4N5S • HCl
26521
ClC1=C(NC2=NC([2H])([2H])C([2H])([2H])N2)C3=NSN=C3C=C1.Cl
TIZOXANIDE
CAS:173903-47-4
Formula: C10H7N3O4S
13693
OC1=C(C(NC2=NC=C([N+]([O-])=O)S2)=O)C=CC=C1
TIZOXANIDE-D4
CAS:1246817-56-0
Formula: C10H3D4N3O4S
28533
OC1=C(C(NC2=NC=C([N+]([O-])=O)S2)=O)C([2H])=C([2H])C([2H])=C1[2H]
TK05
CAS:1245734-61-5
Formula: C31H25ClN2O5
19793
OC(C1=CC(C(C2=NC=C(N(CC3CC3)C4=CC=C(Cl)C=C4)C=C2)=O)=CC=C1C(C5=CC=C(OC)C=C5)=O)=O
TL12-186
CAS:2250025-88-6
Formula: C44H51ClN10O9S
40970
O=C1NC(C(CC1)N2C(C3=C(C2=O)C(NCC(NCCOCCOCCN4CCN(CC4)C5=CC=C(NC6=NC=C(C(NC7=C(S(=O)(C(C)C)=O)C=CC=C7)=N6)Cl)C=C5)=O)=CC=C3)=O)=O
TLR4-C34
CAS:40592-88-9
Formula: C17H27NO9
18512
CC(O[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1NC(C)=O)OC(C)=O)OC(C)=O)COC(C)=O)C
TLR7 AGONIST 2
CAS:1642857-69-9
Formula: C17H16N6O2
28450
NC1=NC(OCC2=NOC(C)=C2)=C3C(C=CN3CC4=NC=CC=C4)=N1
TLR7/8 AGONIST 1 (HYDROCHLORIDE)
CAS:1620278-72-9
Formula: C22H25N5 • 2HCl
28451
NC1=NC2=CC=CC=C2C3=C1N=C(CCCC)N3CC4=CC=C(CN)C=C4.Cl.Cl
TM-N1324
CAS:1144477-35-9
Formula: C18H13ClFN7O
37208
O=C1NC2=C(C(C1)C3=CC=C(C=C3Cl)F)C(C)=NN2C4=NC=NC5=C4NC=N5
TM5275
CAS:1103926-82-4
Formula: C28H27ClN3O5 • Na
23151
ClC1=CC=C(NC(COCC(N2CCN(C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)=O)=O)C(C([O-])=O)=C1.[Na+]
TM5441
CAS:1190221-43-2
Formula: C21H17ClN2O6
22965
O=C(COCC(NC1=CC=C(Cl)C=C1C(O)=O)=O)NC2=CC(C3=COC=C3)=CC=C2
TMA-DPH
CAS:115534-33-3
Formula: C21H24N • C7H7O3S
17294
C[N+](C)(C)C1=CC=C(/C=C/C=C/C=C/C2=CC=CC=C2)C=C1.CC3=CC=C(S([O-])(=O)=O)C=C3
TMB
CAS:54827-17-7
Formula: C16H20N2
36361
NC1=C(C)C=C(C2=CC(C)=C(N)C(C)=C2)C=C1C
TMB (HYDROCHLORIDE HYDRATE)
CAS:207738-08-7
Formula: C16H20N2 • 2HCl [XH2O]
70450
CC1=C(N)C(C)=CC(C2=CC(C)=C(N)C(C)=C2)=C1.Cl.Cl.O
TMB 8 (HYDROCHLORIDE)
CAS:53464-72-5
Formula: C22H37NO5 • HCl
23928
COC1=C(OC)C(OC)=CC(C(OCCCCCCCCN(CC)CC)=O)=C1.Cl
TMCB
CAS:1085822-09-8
Formula: C11H9Br4N3O2
27652
BrC1=C(Br)C(Br)=C(Br)C2=C1N=C(N(C)C)N2CC(O)=O
TMI 1
CAS:287403-39-8
Formula: C17H22N2O5S2
29713
CC#CCOC1=CC=C(S(N2CCSC(C)(C)[C@@H]2C(NO)=O)(=O)=O)C=C1
TMI-005
CAS:287405-51-0
Formula: C17H22N2O6S2
29016
O=S(C1=CC=C(OCC#CCO)C=C1)(N2CCSC(C)(C)[C@@H]2C(NO)=O)=O
TMN 355
CAS:1186372-20-2
Formula: C21H14ClFN2O2
31155
O=C(NC(C1=C(F)C=CC=C1Cl)=O)NC2C(C=CC=C3)=C3C4=C2C=CC=C4
TMP-195
CAS:1314891-22-9
Formula: C23H19F3N4O3
23242
O=C(NCC(C)(C1=COC(C2=CC=CC=C2)=N1)C)C3=CC(C4=NOC(C(F)(F)F)=N4)=CC=C3
TMP269
CAS:1314890-29-3
Formula: C25H21F3N4O3S
17738
O=C(NCC1(C2=NC(C3=CC=CC=C3)=CS2)CCOCC1)C4=CC=CC(C5=NOC(C(F)(F)F)=N5)=C4
TMPD (HYDROCHLORIDE)
CAS:637-01-4
Formula: C10H16N2 • 2HCl
70455
CN(C)C1=CC=C(N(C)C)C=C1.Cl.Cl
TMPYP4 (TOSYLATE)
CAS:36951-72-1
Formula: C44H38N8 • 4C7H7O3S
18474
C[N+]1=CC=C(/C2=C3N/C(C=C/3)=C(C4=N/C(C=C4)=C(C5=CC=C(/C(C6=CC=[N+](C=C6)C)=C7C=CC2=N/7)N5)/C8=CC=[N+](C=C8)C)/C9=CC=[N+](C=C9)C)C=C1.CC%10=CC=C(C=C%10)S([O-])(=O)=O.CC%11=CC=C(C=C%11)S([O-])(=O)=O.CC%12=CC=C(C=C%12)S([O-])(=O)=O.CC%13=CC=C(C=C%13)S(
TMS
CAS:24144-92-1
Formula: C18H20O4
10038
COC1=CC(/C=C/C2=C(OC)C=C(OC)C=C2)=CC(OC)=C1
TN-16
CAS:33016-12-5
Formula: C19H18N2O2
21222
O=C(/C1=C(C)\NC2=CC=CC=C2)NC(CC3=CC=CC=C3)C1=O
TNF-A ANTAGONIST
CAS:199999-60-5
Formula: C58H71N11O15S2
17492
[H]N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CO)C(N[C@@H](CCC(N)=O)C(N[C@H](C(N[C@@H](CC(C)C)C1=O)=O)CC2=CC=C(O)C=C2)=O)=O)=O)CC3=CNC4=C3C=CC=C4)=O)CSSC[C@H](N1)C(N[C@H](C(O)=O)CC5=CC=C(O)C=C5)=O)=O)CC6=CC=C(O)C=C6
TNO155
CAS:1801765-04-7
Formula: C18H24ClN7OS
32525
ClC1=C(N)N=CC=C1SC2=C(N)N=C(N3CCC4([C@H](N)[C@H](C)OC4)CC3)C=N2
TNP-470
CAS:129298-91-5
Formula: C19H28ClNO6
16449
O=C(NC(CCl)=O)O[C@@H]1CC[C@@]2(OC2)[C@]([C@](O3)(C)[C@H]3C/C=C(C)/C)([H])[C@@H]1OC
TNP-ATP (sodium salt)
Formula: C16H13N8O19P3 • 4Na
38492
O=P(OP([O-])([O-])=O)([O-])OP(OC[C@H]1O[C@@H](N2C=NC3=C(N)N=CN=C32)[C@@]4([H])[C@]1([H])OC5(C([N+]([O-])=O)=CC([N+]([O-])=O)C=C5[N+]([O-])=O)O4)([O-])=O.[Na+].[Na+].[Na+].[Na+]
TNP-ATP (TRIETHYLAMMONIUM SALT)
Formula: C16H13N8O19P3 • 4C6H16N
20902
O=P(OP(OP(O)([O-])=O)([O-])=O)([O-])OC[C@@H]1[C@]2([H])[C@](OC3(C([N+]([O-])=O)=C/C(C=C3[N+]([O-])=O)=[N+]([O-])/[O-])O2)([H])[C@H](N4C=NC5=C4N=CN=C5N)O1.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC
TNP-GTP (sodium salt)
Formula: C16H13N8O20P3 • 4Na
38570
O=P(OP([O-])([O-])=O)([O-])OP(OC[C@H]1O[C@@H](N2C=NC3=C2NC(N)=NC3=O)[C@@]4([H])[C@]1([H])OC5(C([N+]([O-])=O)=CC([N+]([O-])=O)C=C5[N+]([O-])=O)O4)([O-])=O.[Na+].[Na+].[Na+].[Na+]
TNP-ß-L-GTP (sodium salt)
Formula: C16H13N8O20P3 • 4Na
38830
O=P(OP([O-])([O-])=O)([O-])OP(OC[C@@H]1O[C@H](N2C=NC3=C2NC(N)=NC3=O)[C@]4([H])[C@@]1([H])OC5(C([N+]([O-])=O)=CC([N+]([O-])=O)C=C5[N+]([O-])=O)O4)([O-])=O.[Na+].[Na+].[Na+].[Na+]
TNT-b10
Formula: C48H96N6O6
39294
O=C(N(CCN(CC(CCCCCCCCCC)O)C)C(N1CCN(C)CC(CCCCCCCCCC)O)=O)N(CCN(C)CC(O)CCCCCCCCCC)C1=O
TOBRAMYCIN
CAS:32986-56-4
Formula: C18H37N5O9
14596
N[C@@H]1[C@@H](O[C@]2([H])[C@H](N)C[C@H](O)[C@@H](CN)O2)[C@H](O)[C@@H](O[C@@]3([H])O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C1
TOCERANIB
CAS:356068-94-5
Formula: C22H25FN4O2
17714
FC1=CC=C(NC(/C2=C\C3=C(C)C(C(NCCN4CCCC4)=O)=C(C)N3)=O)C2=C1
TOCOFERSOLAN
CAS:9002-96-4
Formula: (C2H4O)nC33H54O5
34661
O=C(CCC(OCCO)=O)OC1=C(C)C2=C(OC(CC2)(CCCC(CCCC(CCCC(C)C)C)C)C)C(C)=C1C
TODRALAZINE (HYDROCHLORIDE)
CAS:3778-76-5
Formula: C11H12N4O2 • HCl
20893
O=C(OCC)NNC1=C2C(C=CC=C2)=CN=N1.Cl
TOFA
CAS:54857-86-2
Formula: C19H32O4
1.00053e+007
CCCCCCCCCCCCCCOc1ccc(o1)C(=O)O
Tofacitinib (citrate)
CAS:540737-29-9
Formula: C16H20N6O • C6H8O7
11598
O=C(CC#N)N1CC[C@@H](C)[C@@H](N(C)C2=NC=NC3=C2C=CN3)C1.OC(CC(O)=O)(C(O)=O)CC(O)=O
TOFACITINIB-D3 (CITRATE)
Formula: C16H17D3N6O • C6H8O7
25046
O=C(CC#N)N1CC[C@@H](C)[C@@H](N(C([2H])([2H])[2H])C2=NC=NC3=C2C=CN3)C1.OC(CC(O)=O)(C(O)=O)CC(O)=O
TOFISOPAM
CAS:22345-47-7
Formula: C22H26N2O4
22026
CCC1C(C=C2OC)=C(C(C3=CC(OC)=C(OC)C=C3)=NN=C1C)C=C2OC
Tofogliflozin (hydrate)
CAS:1201913-82-7
Formula: C22H26O6 • H2O
23509
CCC1=CC=C(CC2=CC=C(CO[C@]34O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C3=C2)C=C1.O
TOLAZOLINE (HYDROCHLORIDE)
CAS:59-97-2
Formula: C10H12N2 • HCl
18865
C1(CC2=NCCN2)=CC=CC=C1.Cl
TOLBUTAMIDE
CAS:64-77-7
Formula: C12H18N2O3S
19888
CC1=CC=C(S(NC(NCCCC)=O)(=O)=O)C=C1
TOLBUTAMIDE-D9
CAS:1219794-57-6
Formula: C12H9D9N2O3S
30738
CC1=CC=C(S(NC(NC([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])=O)(=O)=O)C=C1
TOLCAPONE
CAS:134308-13-7
Formula: C14H11NO5
20768
CC1=CC=C(C(C2=CC([N+]([O-])=O)=C(O)C(O)=C2)=O)C=C1
TOLCAPONE-D4
CAS:1246816-93-2
Formula: C14H7D4NO5
28697
CC1=C([2H])C([2H])=C(C(C2=CC([N+]([O-])=O)=C(O)C(O)=C2)=O)C([2H])=C1[2H]
TOLEBRUTINIB
CAS:1971920-73-6
Formula: C26H25N5O3
37723
NC1=C2C(N([C@@]3([H])CN(CCC3)C(C=C)=O)C(N2C4=CC=C(C=C4)OC5=CC=CC=C5)=O)=CC=N1
TOLFENAMIC ACID-D4
CAS:1246820-82-5
Formula: C14H8ClD4NO2
28700
CC1=C(C=CC=C1Cl)NC2=C([2H])C([2H])=C([2H])C([2H])=C2C(O)=O
TOLL-LIKE RECEPTOR 7 LIGAND II
CAS:226907-52-4
Formula: C15H17N5O3
17228
COCCOC1=NC(N)=C2C(N(CC3=CC=CC=C3)C(N2)=O)=N1
TOLMETIN (SODIUM SALT HYDRATE)
CAS:64490-92-2
Formula: C15H14NO3 • Na [2H2O]
18195
CC1=CC=C(C(C2=CC=C(CC([O-])=O)N2C)=O)C=C1.[Na+].O.O
TOLMETIN ß-D-GLUCURONIDE
CAS:71595-19-2
Formula: C21H23NO9
22161
CC1=CC=C(C(C2=CC=C(CC(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O3)=O)N2C)=O)C=C1
TOLNAFTATE
CAS:2398-96-1
Formula: C19H17NOS
21446
CN(C1=CC(C)=CC=C1)C(OC2=CC3=CC=CC=C3C=C2)=S
TOLNAFTATE-D7
CAS:1329835-64-4
Formula: C19H10D7NOS
29048
CN(C1=CC(C)=CC=C1)C(OC2=C([2H])C3=C([2H])C([2H])=C([2H])C([2H])=C3C([2H])=C2[2H])=S
TOLOXATONE
CAS:29218-27-7
Formula: C11H13NO3
33413
CC1=CC(N2C(OC(CO)C2)=O)=CC=C1
TOLPERISONE (HYDROCHLORIDE)
CAS:3644-61-9
Formula: C16H23NO • HCl
26078
CC1=CC=C(C(C(CN2CCCCC2)C)=O)C=C1.Cl
TOLPERISONE-D10 (HYDROCHLORIDE)
CAS:1185160-65-9
Formula: C16H13D10NO • HCl
22592
CC1=CC=C(C(C(CN2C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C2([2H])[2H])C)=O)C=C1.Cl
TOLRESTAT
CAS:82964-04-3
Formula: C16H14F3NO3S
29693
COC1=C(C(F)(F)F)C2=C(C=C1)C(C(N(CC(O)=O)C)=S)=CC=C2
TOLTERODINE DIMER
CAS:854306-72-2
Formula: C35H41NO2
37389
OC1=CC=C(C)C=C1C(CCN(C(C)C)CCC(C2=CC=CC=C2)C3=CC(C)=CC=C3O)C4=CC=CC=C4
TOLTRAZURIL
CAS:69004-03-1
Formula: C18H14F3N3O4S
20767
CC1=CC(N2C(NC(N(C)C2=O)=O)=O)=CC=C1OC3=CC=C(SC(F)(F)F)C=C3
TOLTRAZURIL SULFONE
CAS:69004-04-2
Formula: C18H14F3N3O6S
29655
O=C1N(C)C(N(C2=CC=C(OC3=CC=C(S(C(F)(F)F)(=O)=O)C=C3)C(C)=C2)C(N1)=O)=O
TOLVAPTAN
CAS:150683-30-0
Formula: C26H25ClN2O3
19691
CC1=C(C(NC2=CC(C)=C(C(N3C(C=CC(Cl)=C4)=C4C(O)CCC3)=O)C=C2)=O)C=CC=C1
TOLVAPTAN
CAS:150683-30-0
Formula: C26H25ClN2O3
26301
CC1=C(C(NC2=CC(C)=C(C(N3C(C=CC(Cl)=C4)=C4C(O)CCC3)=O)C=C2)=O)C=CC=C1
TOLVAPTAN-D7
CAS:1246818-18-7
Formula: C26H18ClD7N2O3
26453
O=C(NC1=CC(C)=C(C(N2C(C=CC(Cl)=C3)=C3C(O)CCC2)=O)C=C1)C4=C(C([2H])([2H])[2H])C([2H])=C([2H])C([2H])=C4[2H]
TOMATIDINE (HYDROCHLORIDE)
CAS:6192-62-7
Formula: C27H45NO2 • HCl
16938
C[C@@H](CC1)CN[C@@]21O[C@@]3([H])C[C@@]4([H])[C@]5([H])CC[C@@]6([H])C[C@@H](O)CC[C@]6(C)[C@@]5([H])CC[C@]4(C)[C@@]3([H])[C@@H]2C.Cl
TOMATINE
CAS:17406-45-0
Formula: C50H83NO21
16024
C[C@H]1CC[C@@]2(O[C@]3(C[C@]4([C@@]5(CC[C@]6(C[C@H](CC[C@@]6([C@]5(CC[C@@]4([C@]3([C@@H]2C)[H])C)[H])C)O[C@@]7(O[C@@H]([C@@H]([C@@H]([C@H]7O)O)O[C@]8([C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O[C@]9([C@@H]([C@H]([C@@H](CO9)O)O)O)[H])O[C@@]%10(O[C@@H]([C@H]([
TONABERSAT
CAS:175013-84-0
Formula: C20H19ClFNO4
19796
CC(C1=CC=C2C([C@H](NC(C3=CC=C(F)C(Cl)=C3)=O)[C@H](O)C(C)(C)O2)=C1)=O
TOPIRAMATE
CAS:97240-79-4
Formula: C12H21NO8S
13623
CC1(C)O[C@H]2[C@H]3[C@H](OC(C)(C)O3)CO[C@@]2(COS(N)(=O)=O)O1
TOPIRAMATE-D12
CAS:1279037-95-4
Formula: C12H9D12NO8S
26443
NS(OC[C@]12[C@@H](OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O2)[C@H]3[C@H](OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O3)CO1)(=O)=O
TOPIROXOSTAT
CAS:577778-58-6
Formula: C13H8N6
21267
N#CC1=CC(C2=NN=C(C3=CC=NC=C3)N2)=CC=N1
TOPOTECAN-D6
CAS:1044904-10-0
Formula: C23H17D6N3O5
29082
O=C([C@]1(O)CC)OCC2=C1C=C(C(N=C(C=CC(O)=C3CN(C([2H])([2H])[2H])C([2H])([2H])[2H])C3=C4)=C4C5)N5C2=O
TORASEMIDE
CAS:56211-40-6
Formula: C16H20N4O3S
21312
CC1=CC(NC2=CC=NC=C2S(NC(NC(C)C)=O)(=O)=O)=CC=C1
TORASEMIDE-D7
CAS:1189375-06-1
Formula: C16H13D7N4O3S
26790
CC1=CC(NC2=CC=NC=C2S(NC(NC(C([2H])([2H])[2H])([2H])C([2H])([2H])[2H])=O)(=O)=O)=CC=C1
TORCETRAPIB
CAS:262352-17-0
Formula: C26H25F9N2O4
15028
O=C(OC)N(CC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)[C@H]2C[C@@H](CC)N(C(OCC)=O)C3=CC=C(C(F)(F)F)C=C32
TOREMIFENE (CITRATE)
CAS:89778-27-8
Formula: C26H28ClNO • C6H8O7
20854
ClCC/C(C1=CC=CC=C1)=C(C2=CC=C(OCCN(C)C)C=C2)\C3=CC=CC=C3.OC(CC(O)=O)(C(O)=O)CC(O)=O
TOREMIFENE-D6
Formula: C26H22ClD6NO
30728
ClCC/C(C1=CC=CC=C1)=C(C2=CC=C(OCCN(C([2H])([2H])[2H])C([2H])([2H])[2H])C=C2)\C3=CC=CC=C3
TORIN 1
CAS:1222998-36-8
Formula: C35H28F3N5O2
10997
CCC(N1CCN(C2=CC=C(N3C(C(C=C(C4=CN=C(C=CC=C5)C5=C4)C=C6)=C6N=C7)=C7C=CC3=O)C=C2C(F)(F)F)CC1)=O
TORIN 2
CAS:1223001-51-1
Formula: C24H15F3N4O
14185
NC(N=C1)=CC=C1C2=CC3=C(C=C2)N=CC4=C3N(C5=CC=CC(C(F)(F)F)=C5)C(C=C4)=O
TORMENTIC ACID
CAS:13850-16-3
Formula: C30H48O5
30696
CC1(C)[C@@H](O)[C@H](O)C[C@]2(C)[C@@]3([H])CC=C4[C@]5([H])[C@@](O)(C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CC[C@]21[H]
TOSEDOSTAT
CAS:238750-77-1
Formula: C21H30N2O6
23395
O=C(OC1CCCC1)[C@@H](NC([C@]([C@H](O)C(NO)=O)([H])CC(C)C)=O)C2=CC=CC=C2
TOSUFLOXACIN (TOSYLATE)
CAS:115964-29-9
Formula: C19H15F3N4O3 • C7H8O3S
21427
O=C1C2=C(N=C(N3CCC(N)C3)C(F)=C2)N(C4=CC=C(F)C=C4F)C=C1C(O)=O.CC5=CC=C(S(O)(=O)=O)C=C5
TOSYL PHENYLALANYL CHLOROMETHYL KETONE
CAS:402-71-1
Formula: C17H18ClNO3S
20166
CC1=CC=C(S(N[C@H](C(CCl)=O)CC2=CC=CC=C2)(=O)=O)C=C1
TOSYLLYSINE CHLOROMETHYL KETONE (HYDROCHLORIDE)
CAS:4272-74-6
Formula: C14H21ClN2O3S • HCl
13074
CC1=CC=C(S(N[C@@H](CCCCN)C(CCl)=O)(=O)=O)C=C1.Cl
TOTAROL
CAS:511-15-9
Formula: C20H30O
26412
OC(C=C1)=C(C(C)C)C2=C1[C@]3(C)[C@](CC2)([H])C(C)(C)CCC3
TOYOCAMYCIN (HYDRATE)
Formula: C12H13N5O4 • XH2O
17371
O[C@H]1[C@H](N2C=C(C#N)C3=C2N=CN=C3N)O[C@H](CO)[C@H]1O
TOZADENANT
CAS:870070-55-6
Formula: C19H26N4O4S
28452
COC1=C(N=C(NC(N2CCC(O)(C)CC2)=O)S3)C3=C(N4CCOCC4)C=C1
TP-0463518
CAS:1558021-37-6
Formula: C20H18ClN3O6
33788
O=C(CNC(C1=C(O)CCN(CC2=CN=C(C=C2)OC3=CC=C(C=C3)Cl)C1=O)=O)O
TP-060
CAS:2601393-20-6
Formula: C24H20F4N2O3
41127
O=C1C2=C(CN1C3=CC=C(C(C)(C)O)C=C3)C(C4=C(OCC(F)(F)F)C=C(F)C=C4)=NC=C2
TP-064
CAS:2080306-20-1
Formula: C28H34N4O2
20256
O=C(N(CC1=CC(C2CCN(CCNC)CC2)=NC=C1)C)C3=CC=CC(OC4=CC=CC=C4)=C3
TP-0903
CAS:1341200-45-0
Formula: C24H30ClN7O2S
28757
CN1CCN(CC2=CC=C(NC3=NC(NC4=C(S(N(C)C)(=O)=O)C=CC=C4)=C(Cl)C=N3)C=C2)CC1
TP-238 (HYDROCHLORIDE)
CAS:2415263-05-5
Formula: C22H30N6O3S • HCl
27254
CN(C)CCCOC1=CC=C(C2=NC(S(C)(=O)=O)=NC(NCCCN3N=CC=C3)=C2)C=C1.Cl
TP-3654
CAS:1361951-15-6
Formula: C22H25F3N4O
29571
CC(C)(O)[C@H]1CC[C@H](NC2=NN3C(C=C2)=NC=C3C4=CC=CC(C(F)(F)F)=C4)CC1
TP-472
CAS:2079895-62-6
Formula: C20H19N3O2
20030
O=C(C)C1=CC(C2=CC(C(NC3CC3)=O)=CC=C2C)=C4N=CC=CN41
TP-4748
CAS:1150114-62-7
Formula: C7H9BO5
31459
OB(O)C1=C(C(OCC)=O)OC=C1
TP-808
CAS:852821-06-8
Formula: C26H34N2O5Si
24181
O=C(C(C(OCC1=CC=CC=C1)=NO2)=C2[C@H]3N(C)C)[C@]4(O[Si](C(C)(C)C)(C)C)[C@@]3([H])CC=CC4=O
TPCA-1
CAS:507475-17-4
Formula: C12H10FN3O2S
15115
FC1=CC=C(C2=CC(C(N)=O)=C(NC(N)=O)S2)C=C1
TPEN
CAS:16858-02-9
Formula: C26H28N6
13340
c1ccc(nc1)CN(CCN(Cc1ccccn1)Cc1ccccn1)Cc1ccccn1
TPI-1
CAS:79756-69-7
Formula: C12H6Cl2O2
22480
ClC1=C(C(C(C=C2)=O)=CC2=O)C=C(Cl)C=C1
TPL2 KINASE INHIBITOR
CAS:871307-18-5
Formula: C21H14ClFN6
19710
FC(C=C1)=C(Cl)C=C1NC2=C(C#N)C=NC(C=N3)=C2C=C3NCC4=CN=CC=C4
TPL2 KINASE INHIBITOR (HYDROCHLORIDE)
Formula: C21H14ClFN6 • XHCl
34059
FC(C(Cl)=C1)=CC=C1NC2=C(C#N)C=NC(C=N3)=C2C=C3NCC4=CN=CC=C4.Cl
TPMPA (HYDRATE)
Formula: C6H12NO2P • XH2O
24302
CP(C1=CCNCC1)(O)=O.O
TPP-1 (hydrochloride)
Formula: C107H150N34O32S2 • HCl
37410
O=C(NCC(N[C@@H](CCC(N)=O)C(N[C@@H](CC1=CC=C(O)C=C1)C(N[C@H](C(N[C@@H](CO)C(N[C@@H](CC2=CC=C(O)C=C2)C(N[C@@H](CC3=CNC=N3)C(N[C@@H](CS[H])C(N[C@@H](CC4=CNC5=C4C=CC=C5)C(N[C@@H](CS[H])C(N[C@@H](CC6=CNC7=C6C=CC=C7)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(O)=O)C(N8CC
TPT-260 (HYDROCHLORIDE)
CAS:2076-91-7
Formula: C8H12N4S3 • 2HCl
16079
N=C(N)SCC1=CC=C(CSC(N)=N)S1.Cl.Cl
TPTZ
CAS:3682-35-7
Formula: C18H12N6
28274
C1(C2=NC(C3=NC=CC=C3)=NC(C4=CC=CC=N4)=N2)=CC=CC=N1
TPU-0037A
CAS:485815-59-6
Formula: C46H72N4O10
25761
OC(C/C=C/C(O)C/C=C/C(O)C(C)/C=C/C(O)C/C=C(C)/C(O)C(CCC1C(C)=CC(C(O)C(O)CC2)C2C1(C)C(C3=C(O)CNC3=O)=O)C)CC4N(C(N)=N)CCC4
TPU-0037C
CAS:485815-61-0
Formula: C46H72N4O9
24179
OC(C/C=C/C(O)C/C=C/C(O)C(C)/C=C/C(O)C/C=C(C)/C(O)C(CCC1C(C)=CC(C(O)CCC2)C2C1(C)C(C3=C(O)CNC3=O)=O)C)CC4N(C(N)=N)CCC4
TPX-0005
CAS:1802220-02-5
Formula: C18H18FN5O2
23397
C[C@@H](NC1=NC2=C3C=NN2C=C1)C4=CC(F)=CC=C4O[C@@H](C)CNC3=O
TPX-0022
CAS:2271119-26-5
Formula: C20H20FN7O2
36118
CCN(CC1=C(C#N)C(F)=CC=C1O[C@H](CNC2=O)C)C3=NC4=C2C(N)=NN4C=C3
TRAM-34
CAS:289905-88-0
Formula: C22H17ClN2
23385
ClC(C=CC=C1)=C1C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=CC=N4
TRAMETINIB
CAS:871700-17-3
Formula: C26H23FIN5O4
16292
CC(NC1=CC(N2C(C(C(N(C3CC3)C2=O)=O)=C(NC4=CC=C(I)C=C4F)N5C)=C(C)C5=O)=CC=C1)=O
TRAMETINIB-13C-D3
CAS:2712126-59-3
Formula: C25[13C]H20D3FIN5O4
29144
CC(NC1=CC(N2C(C(C(N(C3CC3)C2=O)=O)=C(NC4=CC=C(I)C=C4F)N5C)=C([13C]([2H])([2H])[2H])C5=O)=CC=C1)=O
TRAMIPROSATE
CAS:3687-18-1
Formula: C3H9NO3S
20701
OS(CCCN)(=O)=O
TRANDOLAPRIL
CAS:87679-37-6
Formula: C24H34N2O5
13522
[H][C@@]12[C@](N(C([C@@H](N[C@H](C(OCC)=O)CCC3=CC=CC=C3)C)=O)[C@H](C(O)=O)C2)([H])CCCC1
TRANDOLAPRILAT (HYDRATE)
CAS:951393-55-8
Formula: C22H30N2O5 • H2O
29577
O=C(O)[C@@H](N[C@@H](C)C(N1[C@](CCCC2)([H])[C@@]2([H])C[C@H]1C(O)=O)=O)CCC3=CC=CC=C3.O
TRANEXAMIC ACID
CAS:1197-18-8
Formula: C8H15NO2
19193
OC([C@@H]1CC[C@@H](CN)CC1)=O
TRANEXAMIC ACID-13C2,15N
CAS:1292837-95-6
Formula: C6[13C2]H15[15N]O2
28804
O[13C]([C@H]1CC[C@H]([13CH2][15NH2])CC1)=O
TRANILAST
CAS:53902-12-8
Formula: C18H17NO5
13044
O=C(/C=C/C1=CC=C(OC)C(OC)=C1)NC2=C(C(O)=O)C=CC=C2
TRANS-?2-11-METHYL-DODECENOIC ACID
CAS:677354-24-4
Formula: C13H24O2
1.00083e+007
CC(C)CCCCCCC/C=C\C(=O)O
TRANS-10-HYDROXY NORTRIPTYLINE
CAS:47132-16-1
Formula: C19H21NO
36660
CNCC/C=C1C2=CC=CC=C2C(CC3=CC=CC=C3/1)O
TRANS-2-DECENOIC ACID
CAS:334-49-6
Formula: C10H18O2
17888
OC(/C=C/CCCCCCC)=O
TRANS-2-OCTENOYL-L-CARNITINE
CAS:152064-94-3
Formula: C15H27NO4
30995
[O-]C(C[C@H](C[N+](C)(C)C)OC(/C=C/CCCCC)=O)=O
TRANS-3'-HYDROXYCOTININE
CAS:34834-67-8
Formula: C10H12N2O2
16100
O=C1C(O)C[C@@H](C2=CC=CN=C2)N1C
TRANS-4-HYDROXY L-PROLINE
CAS:51-35-4
Formula: C5H9NO3
26061
O[C@H]1CN[C@H](C(O)=O)C1
TRANS-4-PHENYL-4-PIPERIDINOCYCLOHEXANOL
CAS:78165-07-8
Formula: C17H25NO
20565
O[C@@H]1CC[C@@](C2=CC=CC=C2)(N3CCCCC3)CC1
TRANS-AUCB
CAS:885012-33-9
Formula: C24H32N2O4
16568
O=C(O)C(C=C1)=CC=C1O[C@H]2CC[C@H](NC(NC34C[C@H]5C[C@H](C[C@H](C5)C4)C3)=O)CC2
TRANS-CARBOXY GLIMEPIRIDE
CAS:1217739-04-2
Formula: C24H32N4O7S
34277
O=C(NS(=O)(C1=CC=C(CCNC(N2C(C(CC)=C(C2)C)=O)=O)C=C1)=O)N[C@H]3CC[C@@H](CC3)C(O)=O
TRANS-CLOVAMIDE
CAS:53755-02-5
Formula: C18H17NO7
16138
OC1=CC=C(/C=C/C(N[C@H](C(O)=O)CC2=CC=C(O)C(O)=C2)=O)C=C1O
TRANS-E-VINIFERIN
CAS:62218-08-0
Formula: C28H22O6
25737
OC1=CC(/C=C/C2=CC=C(O)C=C2)=C3C(O[C@@H](C4=CC=C(O)C=C4)[C@@H]3C5=CC(O)=CC(O)=C5)=C1
TRANS-HYDROXY GLIMEPIRIDE
CAS:600177-94-4
Formula: C24H34N4O6S
34278
O=C(NS(=O)(C1=CC=C(CCNC(N2C(C(CC)=C(C2)C)=O)=O)C=C1)=O)N[C@@H]3CC[C@H](CC3)CO
TRANS-INDOLE-3-ACRYLIC ACID
CAS:29953-71-7
Formula: C11H9NO2
40655
O=C(O)/C=C/C1=CNC2=CC=CC=C21
TRANS-ISRIB
CAS:1597403-47-8
Formula: C22H24Cl2N2O4
16258
ClC1=CC=C(OCC(N[C@@H]2CC[C@@H](NC(COC3=CC=C(Cl)C=C3)=O)CC2)=O)C=C1
TRANS-NED-19
CAS:1354235-96-3
Formula: C30H31FN4O3
17527
FC1=CC=CC=C1N2CCN(CC3=CC([C@H]4N[C@H](C(O)=O)CC5=C4NC6=C5C=CC=C6)=CC=C3OC)CC2
TRANS-NEROLIDOL
CAS:40716-66-3
Formula: C15H26O
25778
C=CC(O)(C)CC/C=C(C)/CC/C=C(C)/C
TRANS-PETROSELINIC ACID
CAS:593-40-8
Formula: C18H34O2
20026
OC(CCCC/C=C/CCCCCCCCCCC)=O
trans-Petroselinic Acid methyl ester
CAS:14620-36-1
Formula: C19H36O2
36670
O=C(OC)CCCC/C=C/CCCCCCCCCCC
TRANS-RESVERATROL
CAS:501-36-0
Formula: C14H12O3
70675
Oc1ccc(cc1)\C=C/c1cc(O)cc(O)c1
trans-Resveratrol-3-O-ß-D-Glucuronide
CAS:387372-17-0
Formula: C20H20O9
13832
O[C@H]1[C@H](O)[C@@H](O)[C@H](OC2=CC(/C=C/C3=CC=C(O)C=C3)=CC(O)=C2)O[C@@H]1C(O)=O
TRANS-RESVERATROL-4'-O-D-GLUCURONIDE
CAS:387372-20-5
Formula: C20H20O9
13833
OC1=CC(O)=CC(/C=C/C2=CC=C(C=C2)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O3)=C1
trans-ß-Farnesene
CAS:18794-84-8
Formula: C15H24
31502
C=CC(CC/C=C(C)/CC/C=C(C)/C)=C
TRANS-TRISMETHOXY RESVERATROL
CAS:22255-22-7
Formula: C17H18O3
10188
COc1ccc(cc1)\C=C/c1cc(OC)cc(OC)c1
TRANS-UROCANIC ACID
CAS:3465-72-3
Formula: C6H6N2O2
16228
OC(/C=C/C1=CN=CN1)=O
TRANS-VACCENIC ACID-D13
Formula: C18H21D13O2
27717
OC(CCCCCCCCC/C=C/C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])(C([2H])([2H])[2H])[2H])=O
TRANS-ZEATIN
CAS:1637-39-4
Formula: C10H13N5O
13226
OC/C(C)=C/CNC1=NC=NC2=C1N=CN2
TRANS-ZEATIN RIBOSIDE
CAS:6025-53-2
Formula: C15H21N5O5
30747
C/C(CO)=C\CNC1=C(N=CN2[C@]3([H])O[C@H](CO)[C@@H](O)[C@H]3O)C2=NC=N1
TRANS-ZEATIN-D5
Formula: C10H8D5N5O
28534
OC([2H])([2H])/C(C([2H])([2H])[2H])=C/CNC1=NC=NC2=C1N=CN2
TRANSCROCETIN
CAS:27876-94-4
Formula: C20H24O4
24217
OC(/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C(O)=O)=O
Transportan (trifluoroacetate salt)
Formula: C134H227N35O32 • XCF3COOH
37497
OC(C(F)(F)F)=O.[H]NCC(N[C@H](C(N[C@]([C@@H](C)O)([H])C(N[C@@H](CC(C)C)C(N[C@@H](CC(N)=O)C(N[C@@H](CO)C(N[C@H](C(NCC(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CCCCN)C(N[C@]([C@H](CC)C)([H])C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CCCCN)C(N
TRANYLCYPROMINE (HYDROCHLORIDE)
CAS:1986-47-6
Formula: C9H11N • HCl
1.00105e+007
N[C@@H]1CC1c1ccccc1
TRAP-6 amide (trifluoroacetate salt)
Formula: C34H57N11O8 • XCF3COOH
36881
NC(C[C@@H](C(N)=O)NC([C@H](CCCNC(N)=N)NC([C@H](CC(C)C)NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](N)CO)=O)CC1=CC=CC=C1)=O)=O)=O)=O)=O.OC(C(F)(F)F)=O
TRAP-6 PEPTIDE (TRIFLUOROACETATE SALT)
Formula: C34H56N10O9 • XCF3COOH
24125
O=C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CC(N)=O)=O)CCCNC(N)=N)=O)CC(C)C)=O)[C@@H](NC([C@H](CO)N)=O)CC1=CC=CC=C1.FC(F)(C(O)=O)F
TRAPIDIL
CAS:15421-84-8
Formula: C10H15N5
33496
CCN(CC)C1=CC(C)=NC2=NC=NN21
TRAUMATIC ACID
CAS:6402-36-4
Formula: C12H20O4
88820
OC(=O)CCCCCCCC/C=C\C(=O)O
TRC051384
CAS:867164-40-7
Formula: C25H31N5O4
29199
O=C(NC1=CC=C(C(/C=C/C2=CC=CC(N3CCOCC3)=N2)=O)C=C1)NCCN4CCOCC4
TREHALOSE (HYDRATE)
CAS:6138-23-4
Formula: C12H22O11 • 2H2O
20517
OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@]1([H])O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2.O.O
Trehalose 6,6'-Dibehenate
CAS:66758-35-8
Formula: C56H106O13
37911
O[C@H]([C@H]1O)[C@H](O[C@@H]([C@H]1O)COC(CCCCCCCCCCCCCCCCCCCCC)=O)O[C@H]([C@@H]([C@H]2O)O)O[C@@H]([C@H]2O)COC(CCCCCCCCCCCCCCCCCCCCC)=O
TREHALOSE 6-PHOSPHATE (POTASSIUM SALT HYDRATE)
Formula: C12H21O14P • 2K [XH2O]
18925
OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@]1([H])O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COP([O-])([O-])=O)O2.[K+].[K+].O
TRELAGLIPTIN
CAS:865759-25-7
Formula: C18H20FN5O2
18504
O=C(N(C)C(N1CC2=CC(F)=CC=C2C#N)=O)C=C1N3CCC[C@@H](N)C3
TRELAGLIPTIN-13C-D3
CAS:2707203-34-5
Formula: C17[13C]H17D3FN5O2
28203
O=C(N([13C]([2H])([2H])[2H])C(N1CC2=CC(F)=CC=C2C#N)=O)C=C1N3CCC[C@@H](N)C3
TRENBOLONE
CAS:10161-33-8
Formula: C18H22O2
16896
O=C1CCC2=C3[C@@]([C@@](CC[C@@H]4O)([H])[C@]4(C)C=C3)([H])CCC2=C1
TRENBOLONE ACETATE
CAS:10161-34-9
Formula: C20H24O3
24966
O=C1CCC2=C3[C@@]([C@@](CC[C@@H]4OC(C)=O)([H])[C@]4(C)C=C3)([H])CCC2=C1
TREPROSTINIL (DIETHANOLAMINE SALT)
CAS:830354-48-8
Formula: C23H33O5 • C4H12NO2
11927
O=C([O-])COC1=C(C[C@](C[C@@H](O)[C@@H]2CC[C@@H](O)CCCCC)([H])[C@]2([H])C3)C3=CC=C1.OCC[NH2+]CCO
TREQUINSIN (HYDROCHLORIDE)
CAS:78416-81-6
Formula: C24H27N3O3 • HCl
17217
O=C(N/1C)N2CCC3=CC(OC)=C(OC)C=C3C2=CC1=N/C4=C(C)C=C(C)C=C4C.Cl
TRESTOLONE ACETATE
CAS:6157-87-5
Formula: C21H30O3
31974
C[C@H]1[C@@]2([H])[C@@]3([H])[C@@]([C@H](CC3)OC(C)=O)(CC[C@]2([H])[C@]4([H])C(C1)=CC(CC4)=O)C
tri-GalNAc COOH
CAS:1953146-81-0
Formula: C75H134N10O35
40934
O[C@@H]1[C@H](O)[C@@H](NC(C)=O)[C@H](OCCCCC(NCCCNC(CCOCC(COCCC(NCCCNC(CCCCO[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2NC(C)=O)O)O)CO)=O)=O)(COCCC(NCCCNC(CCCCO[C@@H]3O[C@@H]([C@@H]([C@@H]([C@H]3NC(C)=O)O)O)CO)=O)=O)NC(CCOCCOCCOCCOCCOCCC(O)=O)=O)=O)=O)O[C@@H]1CO
Tri-GalNAc(OAc)3 (trifluoroacetate salt)
CAS:1159408-65-7
Formula: C79H128N10O36 • CF3COOH
40846
OC(C(F)(F)F)=O.O=C(O[C@@H]1[C@H](OC(C)=O)[C@@H](NC(C)=O)[C@H](OCCCCC(NCCCNC(CCOCC(COCCC(NCCCNC(CCCCO[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2NC(C)=O)OC(C)=O)OC(C)=O)COC(C)=O)=O)=O)(COCCC(NCCCNC(CCCCO[C@@H]3O[C@@H]([C@@H]([C@@H]([C@H]3NC(C)=O)OC(C)=O)OC(C)=O)COC
TRI-SALICYLIC ACID
CAS:85531-17-5
Formula: C21H14O7
37348
O=C(C1=C(OC(C2=C(O)C=CC=C2)=O)C=CC=C1)OC3=CC=CC=C3C(O)=O
TRIACETYLPHLOROGLUCINOL
CAS:2161-87-7
Formula: C12H12O6
27073
OC1=C(C(C)=O)C(O)=C(C(C)=O)C(O)=C1C(C)=O
TRIACONTANOIC ACID
CAS:506-50-3
Formula: C30H60O2
34032
OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O
TRIACONTANOIC ACID METHYL ESTER
CAS:629-83-4
Formula: C31H62O2
26727
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(OC)=O
TRIACSIN C
CAS:76896-80-5
Formula: C11H17N3O
1.00074e+007
CCC/C=C/C/C=C/C=C/C=N/NN=O
TRIADIMEFON
CAS:43121-43-3
Formula: C14H16ClN3O2
18714
ClC1=CC=C(OC(N2C=NC=N2)C(C(C)(C)C)=O)C=C1
TRIADIMENOL
CAS:55219-65-3
Formula: C14H18ClN3O2
24216
ClC1=CC=C(OC(N2N=CN=C2)C(O)C(C)(C)C)C=C1
TRIAMCINOLONE
CAS:124-94-7
Formula: C21H27FO6
28275
F[C@]12[C@@]([C@@](C[C@@H](O)[C@]3(O)C(CO)=O)([H])[C@]3(C)C[C@@H]2O)([H])CCC4=CC(C=C[C@@]41C)=O
TRIAMCINOLONE ACETONIDE
CAS:76-25-5
Formula: C24H31FO6
18026
CC1(C)O[C@]2([H])C[C@@]3([H])[C@]4([H])CCC5=CC(C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(CO)=O)O1)=O
TRIAMCINOLONE ACETONIDE-D7
Formula: C24H24D7FO6
25236
O=C1C=C[C@@]2(C)C(CC[C@]3([H])[C@]2(F)[C@@H](O)C[C@@]4(C)[C@@]3([H])C[C@]5([H])[C@@]4(C(C([2H])O)=O)OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O5)=C1
TRIAMTERENE
CAS:396-01-0
Formula: C12H11N7
21242
NC1=NC(N)=NC(N=C2N)=C1N=C2C3=CC=CC=C3
TRIAMTERENE
CAS:396-01-0
Formula: C12H11N7
22486
NC1=NC(N)=NC(N=C2N)=C1N=C2C3=CC=CC=C3
TRIAMTERENE-D5
CAS:1189922-23-3
Formula: C12H6D5N7
33815
NC1=NC(N)=NC2=C1N=C(C3=C([2H])C([2H])=C([2H])C([2H])=C3[2H])C(N)=N2
TRIAZAVIRIN
CAS:928659-17-0
Formula: C5H3N6O3S • Na [2H2O]
36052
O=C1C([N+]([O-])=O)=N[N-]C2=NC(SC)=NN12.[Na+].O.O
TRIAZOLAM
CAS:28911-01-5
Formula: C17H12Cl2N4
22577
ClC1=CC=C2C(C(C3=CC=CC=C3Cl)=NCC4=NN=C(C)N42)=C1
TRIAZOLOMETHYLINDOLE-3-ACETIC ACID
CAS:177270-91-6
Formula: C13H12N4O2
35103
O=C(CC1=CNC2=C1C=C(CN3N=CN=C3)C=C2)O
TRIAZOLOPYRIDINONE
CAS:6969-71-7
Formula: C6H5N3O
34393
O=C1NN=C2C=CC=CN21
TRIBENOSIDE
CAS:10310-32-4
Formula: C29H34O6
33498
O[C@H]([C@H]1OCC2=CC=CC=C2)C(OCC)O[C@]1([H])[C@@H](COCC3=CC=CC=C3)OCC4=CC=CC=C4
TRIBULOSIDE (HYDRATE)
Formula: C30H26O13 • XH2O
33218
O=C(C(O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(C=CC2=CC=C(C=C2)O)=O)=C(C3=CC=C(C=C3)O)OC4=CC(O)=C5)C4=C5O.O
TRICHLORMETHIAZIDE
CAS:133-67-5
Formula: C8H8Cl3N3O4S2
29331
NS(C1=C(Cl)C=C(NC(C(Cl)Cl)NS2(=O)=O)C2=C1)(=O)=O
TRICHOSTATIN A
CAS:58880-19-6
Formula: C17H22N2O3
89730
CN(C)C1=CC=C(C([C@H](C)/C=C(C)/C=C/C(N(O)[H])=O)=O)C=C1
TRICHOSTATIN C
CAS:68676-88-0
Formula: C23H32N2O8
20220
CN(C)C1=CC=C(C([C@H](C)/C=C(C)/C=C/C(NO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=O)=O)C=C1
TRICIN
CAS:520-32-1
Formula: C17H14O7
35835
O=C1C=C(C2=CC(OC)=C(O)C(OC)=C2)OC3=C1C(O)=CC(O)=C3
TRICIRIBINE
CAS:35943-35-2
Formula: C13H16N6O4
1.00102e+007
OC[C@H]1O[C@H](C(O)C1O)n1cc2c(N)nn(C)c3ncnc1c23
TRICIRIBINE PHOSPHATE
CAS:61966-08-3
Formula: C13H17N6O7P
37985
O=P(O)(O)OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C=C3C(C2=NC=N4)=C4N(C)N=C3N)O1
TRICLABENDAZOLE
CAS:68786-66-3
Formula: C14H9Cl3N2OS
18883
ClC1=CC=CC(OC2=C(Cl)C=C(NC(SC)=N3)C3=C2)=C1Cl
TRICLABENDAZOLE-13C-D3
CAS:2938916-53-9
Formula: C13[13C]H6D3Cl3N2OS
34011
ClC1=CC=CC(OC2=C(Cl)C=C(N=C(S[13C]([2H])([2H])[2H])N3)C3=C2)=C1Cl
TRICLOSAN
CAS:3380-34-5
Formula: C12H7Cl3O2
20342
ClC1=C(OC2=CC=C(Cl)C=C2O)C=CC(Cl)=C1
TRICOSANOIC ACID
CAS:2433-96-7
Formula: C23H46O2
26867
CCCCCCCCCCCCCCCCCCCCCCC(O)=O
TRICOSANOIC ACID ETHYL ESTER
CAS:18281-07-7
Formula: C25H50O2
1.00069e+007
CCCCCCCCCCCCCCCCCCCCCCC(OCC)=O
TRICOSANOIC ACID METHYL ESTER
CAS:2433-97-8
Formula: C24H48O2
26868
CCCCCCCCCCCCCCCCCCCCCCC(OC)=O
TRICOSANOYL ETHANOLAMIDE
CAS:171022-15-4
Formula: C25H51NO2
9.00174e+006
O=C(CCCCCCCCCCCCCCCCCCCCCC)NCCO
TRICYCLENE
CAS:508-32-7
Formula: C10H16
34290
CC1(C2CC3C(C31C)C2)C
TRIDECANOIC ACID
CAS:638-53-9
Formula: C13H26O2
19725
OC(CCCCCCCCCCCC)=O
TRIDECANOIC ACID METHYL ESTER
CAS:1731-88-0
Formula: C14H28O2
26721
O=C(CCCCCCCCCCCC)OC
TRIENTINE (HYDROCHLORIDE)
CAS:38260-01-4
Formula: C6H18N4 • 2HCl
24000
NCCNCCNCCN.Cl.Cl
TRIFLOXYSTROBIN
CAS:141517-21-7
Formula: C20H19F3N2O4
25825
C/C(C1=CC(C(F)(F)F)=CC=C1)=N\OCC2=C(/C(C(OC)=O)=N\OC)C=CC=C2
TRIFLOXYSTROBIN-D6
Formula: C20H13D6F3N2O4
39591
C/C(C1=CC(C(F)(F)F)=CC=C1)=N\OC([2H])([2H])C2=C(/C(C(OC)=O)=N\OC)C([2H])=C([2H])C([2H])=C2[2H]
TRIFLUMURON
CAS:64628-44-0
Formula: C15H10ClF3N2O3
30858
ClC1=CC=CC=C1C(NC(NC2=CC=C(OC(F)(F)F)C=C2)=O)=O
TRIFLUOPERAZINE (HYDROCHLORIDE)
CAS:440-17-5
Formula: C21H24F3N3S • 2HCl
15068
CN(CC1)CCN1CCCN2C3=C(C=CC(C(F)(F)F)=C3)SC4=CC=CC=C42.Cl.Cl
TRIFLUOPERAZINE N-GLUCURONIDE
CAS:165602-90-4
Formula: C27H32F3N3O6S
34299
C[N+](CC1)([C@H]2[C@H](O)[C@@H](O)[C@@H]([C@@H](C([O-])=O)O2)O)CCN1CCCN3C4=CC(C(F)(F)F)=CC=C4SC5=CC=CC=C53
TRIFLUOPERAZINE-D3 (HYDROCHLORIDE)
CAS:1432064-02-2
Formula: C21H21D3F3N3S • 2HCl
30718
FC(F)(F)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(C([2H])([2H])[2H])CC4.Cl.Cl
TRIFLUOROACETYL TRIPEPTIDE-2 (ACETATE)
Formula: C21H28F3N3O6 • XC2H4O2
35389
OC([C@H](C(C)C)NC([C@@H](NC([C@H](C(C)C)NC(C(F)(F)F)=O)=O)CC1=CC=C(O)C=C1)=O)=O.CC(O)=O
TRIFLUOROTHYMIDINE
CAS:70-00-8
Formula: C10H11F3N2O5
21366
O=C(C(C(F)(F)F)=CN1[C@@H]2O[C@H](CO)[C@@H](O)C2)NC1=O
TRIFLUSAL
CAS:322-79-2
Formula: C10H7F3O4
30274
OC(C1=C(OC(C)=O)C=C(C(F)(F)F)C=C1)=O
TRIFOLIRHIZIN
CAS:6807-83-6
Formula: C22H22O10
34655
[H][C@]1(C2=CC(OCO3)=C3C=C2O4)[C@]4([H])C5=CC=C(C=C5OC1)O[C@@H]6O[C@@H]([C@H]([C@@H]([C@H]6O)O)O)CO
TRIGONELLINE (CHLORIDE)
CAS:6138-41-6
Formula: C7H8NO2 • Cl
11904
OC(C1=C[N+](C)=CC=C1)=O.[Cl-]
TRIGONELLINE-D3 (CHLORIDE)
Formula: C7H5D3NO2 • Cl
36340
O=C(C1=C[N+](C([2H])([2H])[2H])=CC=C1)O.[Cl-]
TRIHEXYPHENIDYL (HYDROCHLORIDE)
CAS:52-49-3
Formula: C20H31NO • HCl
27643
OC(CCN1CCCCC1)(C2=CC=CC=C2)C3CCCCC3.Cl
TRIHYDROXYCHOLESTANOIC ACID
CAS:547-98-8
Formula: C27H46O5
26098
C[C@H](CCCC(C)C(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C
Trilaciclib (hydrochloride)
CAS:1977495-97-8
Formula: C24H30N8O • 2HCl
37297
O=C1NCC2(CCCCC2)N3C4=NC(NC5=CC=C(N6CCN(CC6)C)C=N5)=NC=C4C=C13.Cl.Cl
TRILOBATIN
CAS:4192-90-9
Formula: C21H24O10
25837
OC1=CC=C(CCC(C2=C(O)C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2O)=O)C=C1
TRILOSTANE
CAS:13647-35-3
Formula: C20H27NO3
14164
OC1=C(C#N)C[C@@]2(C)[C@@]3(CC[C@]4([H])[C@]2([H])CC[C@@]5(C)[C@@]4([H])CC[C@@H]5O)[C@@H]1O3
TRIM
CAS:25371-96-4
Formula: C10H7N2F3
81310
FC(F)(F)c1ccccc1n1cncc1
TRIMEBUTINE
CAS:39133-31-8
Formula: C22H29NO5
31574
O=C(C1=CC(OC)=C(C(OC)=C1)OC)OCC(C2=CC=CC=C2)(N(C)C)CC
TRIMEPERIDINE (HYDROCHLORIDE)
CAS:125-80-4
Formula: C17H25NO2 • HCl
9.00365e+006
O=C(CC)OC1(CC(C)N(CC1C)C)C2=CC=CC=C2.Cl
TRIMESIC ACID
CAS:554-95-0
Formula: C9H6O6
19198
O=C(O)C1=CC(C(O)=O)=CC(C(O)=O)=C1
TRIMETAZIDINE (HYDROCHLORIDE)
CAS:13171-25-0
Formula: C14H22N2O3 • 2HCl
18165
COC1=C(OC)C=CC(CN2CCNCC2)=C1OC.Cl.Cl
Trimetazidine-d8 (hydrochloride)
CAS:1219795-37-5
Formula: C14H14D8N2O3 • 2HCl
39810
[2H]C1(C([2H])(NC([2H])(C([2H])(N1CC2=C(OC)C(OC)=C(OC)C=C2)[2H])[2H])[2H])[2H].Cl.Cl
TRIMETHADIONE
CAS:127-48-0
Formula: C6H9NO3
23893
O=C(OC1(C)C)N(C)C1=O
TRIMETHOBENZAMIDE (HYDROCHLORIDE)
CAS:554-92-7
Formula: C21H28N2O5 • HCl
24145
COC1=CC(C(NCC2=CC=C(OCCN(C)C)C=C2)=O)=CC(OC)=C1OC.Cl
TRIMETHOPRIM
CAS:738-70-5
Formula: C14H18N4O3
16473
COC1=C(OC)C(OC)=CC(CC2=CN=C(N)N=C2N)=C1
TRIMETHOPRIM-D3
CAS:1189923-38-3
Formula: C14H15D3N4O3
26119
COC1=CC(CC2=CN=C(N)N=C2N)=CC(OC)=C1OC([2H])([2H])[2H]
TRIMETHOPRIM-PEG-AMINE (TRIFLUOROACETATE SALT)
Formula: C23H36N6O7 • 3CF3COOH
9.00211e+006
COC1=C(OCC(NCCOCCOCCOCCN)=O)C(OC)=CC(CC2=CC(N)=NC(N)=N2)=C1.FC(F)(C(O)=O)F.FC(F)(C(O)=O)F.FC(F)(C(O)=O)F
TRIMETHYLAMINE N-OXIDE
CAS:1184-78-7
Formula: C3H9NO
17354
C[N](C)(C)=O
TRIMETHYLAMINE-D9 N-OXIDE
CAS:1161070-49-0
Formula: C3D9NO
31449
O=[N](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]
TRIMIDOX
CAS:95933-74-7
Formula: C7H8N2O4
1.00091e+007
OC1=C(O)C(O)=CC(C(NO)=N)=C1
TRIMIDOX (HYDROCHLORIDE)
CAS:95933-75-8
Formula: C7H8N2O4 • HCl
1.00111e+007
Cl.ONC(=N)c1cc(O)c(O)c(O)c1
TRIMIPRAMINE (MALEATE)
CAS:521-78-8
Formula: C20H26N2 • C4H4O4
15921
CN(C)CC(C)CN1C2=C(C=CC=C2)CCC3=C1C=CC=C3.OC(/C=C\C(O)=O)=O
TRIMIPRAMINE N-OXIDE
CAS:14171-70-1
Formula: C20H26N2O
35414
O=[N](C)(CC(CN1C2=C(CCC3=C1C=CC=C3)C=CC=C2)C)C
TRIMIPRAMINE-D3 (MALEATE)
Formula: C20H23D3N2 • C4H4O4
31919
CN(C([2H])([2H])[2H])CC(C)CN1C2=C(C=CC=C2)CCC3=C1C=CC=C3.OC(/C=C\C(O)=O)=O
TRINACTIN
CAS:7561-71-9
Formula: C43H70O12
25741
O=C(O[C@@H](C)C[C@@]1([H])O[C@]([C@H]2C)([H])CC1)[C@@H](C)[C@]3([H])CC[C@@](C[C@@H](CC)OC([C@@H]([C@]4([H])O[C@@](C[C@@H](OC([C@@H](C)[C@@]5([H])O[C@@](CC5)([H])C[C@@H](CC)OC2=O)=O)CC)([H])CC4)C)=O)([H])O3
TRIPARANOL
CAS:78-41-1
Formula: C27H32ClNO2
20918
CC1=CC=C(C(CC2=CC=C(Cl)C=C2)(O)C3=CC=C(OCCN(CC)CC)C=C3)C=C1
TRIPHENYLPHOSPHINE OXIDE
CAS:791-28-6
Formula: C18H15OP
9.00029e+006
O=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
TRIPTOPHENOLIDE
CAS:74285-86-2
Formula: C20H24O3
34390
C[C@@]12[C@](CCC3=C(O)C(C(C)C)=CC=C32)([H])C4=C(C(OC4)=O)CC1
TRIPTORELIN (TRIFLUOROACETATE SALT)
CAS:2240176-35-4
Formula: C64H82N18O13 • XCF3COOH
28613
O=C([C@@H]1CCC(N1)=O)N[C@@H](CC2=CN=CN2)C(N[C@@H](CC3=CNC4=CC=CC=C34)C(N[C@@H](CO)C(N[C@@H](CC5=CC=C(O)C=C5)C(N[C@H](CC6=CNC7=CC=CC=C67)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N8CCC[C@H]8C(NCC(N)=O)=O)=O=C([C@@H]1CCC(N1)=O)N[C@@H](CC2=CN=CN2)C(N[C@@H](CC3=CNC4=CC
TRIS(4,7-DIPHENYL-1,10-PHENANTHROLINE)RUTHENIUM II DICHLORIDE COMPLEX
CAS:36309-88-3
Formula: C72H48N6Ru • 2Cl
16117
[N]1(C=CC(C2=CC=CC=C2)=C3C=C4)=C3C5=C4C(C6=CC=CC=C6)=CC=[N]5[Ru+2]178([N](C=CC(C9=CC=CC=C9)=C%10C=C%11)=C%10C%12=C%11C(C%13=CC=CC=C%13)=CC=[N]8%12)[N]%14=CC=C(C%15=CC=CC=C%15)C%16=C%14C%17=[N]7C=CC(C%18=CC=CC=C%18)=C%17C=C%16.[Cl-].[Cl-]
TRIS-NTA
CAS:862778-60-7
Formula: C43H72N8O22
28789
O=C(CC[C@H]([NH+](CC(O)=O)CC(O)=O)C(O)=O)N1CCN(C(CCCCC[NH3+])=O)CCCN(C(CC[C@H]([NH+](CC(O)=O)CC(O)=O)C(O)=O)=O)CCN(C(CC[C@H]([NH+](CC(O)=O)CC(O)=O)C(O)=O)=O)CCC1
TRITICONAZOLE
CAS:131983-72-7
Formula: C17H20ClN3O
18726
ClC1=CC=C(/C=C2C(CN3C=NC=N3)(O)C(C)(C)CC\2)C=C1
TRITYLOLMESARTAN MEDOXOMIL
CAS:144690-92-6
Formula: C48H44N6O6
34854
O=C(OCC1=C(C)OC(O1)=O)C2=C(C(C)(O)C)N=C(CCC)N2CC3=CC=C(C4=C(C5=NN=NN5C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C=CC=C4)C=C3
TRO 19622
CAS:22033-87-0
Formula: C27H45NO
21264
O/N=C1CC[C@@]2(C)C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCCC(C)C)=C\1
Trofinetide (acetate)
Formula: C13H21N3O6 • XC2H4O2
38579
O=C([C@@](N1C(CN)=O)(CCC1)C)N[C@H](C(O)=O)CCC(O)=O.CC(O)=O
TROGLITAZONE
CAS:97322-87-7
Formula: C24H27NO5S
71750
O=C1NC(=O)C(S1)Cc1ccc(cc1)OCC1(C)CCc2c(O1)c(C)c(C)c(O)c2C
TROGLITAZONE-D4
CAS:2749370-85-0
Formula: C24H23D4NO5S
28908
CC1=C2C(CCC(COC3=C([2H])C([2H])=C(CC4C(NC(S4)=O)=O)C([2H])=C3[2H])(C)O2)=C(C)C(O)=C1C
TROLOX
CAS:53188-07-1
Formula: C14H18O4
1.00117e+007
Cc1c2OC(C)(CCc2c(C)c(O)c1C)C(=O)O
TROPACOCAINE (HYDROCHLORIDE)
CAS:637-23-0
Formula: C15H19NO2 • HCl
18063
CN1[C@H]2C[C@@H](OC(C3=CC=CC=C3)=O)C[C@@H]1CC2.Cl
TROPICAMIDE
CAS:1508-75-4
Formula: C17H20N2O2
16606
OCC(C(N(CC1=CC=NC=C1)CC)=O)C2=CC=CC=C2
TROPIFEXOR
CAS:1383816-29-2
Formula: C29H25F4N3O5S
25748
FC1=C2C(SC(N3[C@H]4CC[C@@H]3C[C@H](OCC5=C(C6CC6)ON=C5C7=CC=CC=C7OC(F)(F)F)C4)=N2)=CC(C(O)=O)=C1
TROPINE
CAS:120-29-6
Formula: C8H15NO
18627
O[C@H]1C[C@@H](CC2)N(C)[C@@H]2C1
TROPINONE
CAS:532-24-1
Formula: C8H13NO
34287
O=C1CC2N(C(CC2)C1)C
TROPISETRON-D5
CAS:1220284-86-5
Formula: C17H15D5N2O2
30736
CN1[C@@H]2C[C@@H](OC(C3=C([2H])NC4=C3C([2H])=C([2H])C([2H])=C4[2H])=O)C[C@H]1CC2
TROPODITHIETIC ACID
CAS:750590-18-2
Formula: C8H4O3S2
23244
O=C1C=CC=C2C(SS2)=C1C(O)=O
TROPOLONE
CAS:533-75-5
Formula: C7H6O2
29674
OC1=CC=CC=CC1=O
TROSPIUM (CHLORIDE)
CAS:10405-02-4
Formula: C25H30NO3 • Cl
21279
O=C(C(C1=CC=CC=C1)(O)C2=CC=CC=C2)OC3C[C@]([N+]45CCCC4)([H])CC[C@@]5([H])C3.[Cl-]
TROSPIUM-D8 (CHLORIDE)
Formula: C25H22D8NO3 • Cl
26686
O=C(C(C1=CC=CC=C1)(O)C2=CC=CC=C2)OC3C[C@]([N+]45C([2H])([2H])C([2H])([2H])C([2H])([2H])C4([2H])[2H])([H])CC[C@@]5([H])C3.[Cl-]
Trotabresib
CAS:1706738-98-8
Formula: C21H21NO4S
36292
O=C1C2=C(C(C3=C(OCC4CC4)C=CC(S(=O)(C)=O)=C3)=CN1C)C=CC=C2
TROVAFLOXACIN (MESYLATE)
CAS:147059-75-4
Formula: C20H15F3N4O3 • CH4SO3
9.0003e+006
O=C1C(C(O)=O)=CN(C2=CC=C(F)C=C2F)C3=NC(N4C[C@H]([C@]5(N)[H])[C@H]5C4)=C(F)C=C31.CS(=O)(O)=O
TROXERUTIN
CAS:7085-55-4
Formula: C33H42O19
27220
O=C1C2=C(O)C=C(OCCO)C=C2OC(C3=CC=C(OCCO)C(OCCO)=C3)=C1O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)O4
TROXIPIDE
CAS:30751-05-4
Formula: C15H22N2O4
30616
O=C(C1=CC(OC)=C(OC)C(OC)=C1)NC2CCCNC2
TRPM4-IN-5
CAS:351424-20-9
Formula: C15H11Cl2NO4
36019
O=C(C1=C(NC(COC2=C(Cl)C=CC=C2)=O)C=C(Cl)C=C1)O
TRPV1-Tat (trifluoroacetate salt)
Formula: C127H206N50O29S • XCF3COOH
36955
OC(C(F)(F)F)=O.O=C(N[C@@H](CC(O)=O)C(N[C@@H](CC(O)=O)C(N[C@@H](CC1=CC=C(O)C=C1)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CS[H])C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(C)C)C(N[C@@H](CC4=CC=C(O)C=C4)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCC
TRUE BLUE
CAS:71431-30-6
Formula: C20H16N4O2 • 2HCl
26863
N=C(N)C1=CC=C2C(C=C(/C=C/C3=CC4=C(C=CC(C(N)=N)=C4)O3)O2)=C1.Cl.Cl
TRV-130 (HYDROCHLORIDE)
CAS:1401031-39-7
Formula: C22H30N2O2S • HCl
30624
COC1=C(CNCC[C@@](C2)(C3=CC=CC=N3)CCOC42CCCC4)SC=C1.Cl
TRX-818 (SODIUM SALT)
CAS:1256037-62-3
Formula: C16H11FNO6P • 2Na
22209
O=C1C2=C(C=CC(OC)=C2OP([O-])([O-])=O)NC(C3=CC(F)=CC=C3)=C1.[Na+].[Na+]
TRX0237 (MESYLATE)
CAS:1236208-20-0
Formula: C16H19N3S • 2CH3SO3H
34307
O=S(O)(C)=O.CN(C)C1=CC=C2NC3=CC=C(N(C)C)C=C3SC2=C1.O=S(O)(C)=O
TRYPACIDIN
CAS:1900-29-4
Formula: C18H16O7
33079
O=C1C2(C(C(OC)=O)=CC(C=C2OC)=O)OC3=CC(C)=CC(OC)=C13
TRYPTAMINE
CAS:61-54-1
Formula: C10H12N2
20995
NCCC1=CNC2=CC=CC=C21
TRYPTAMINE
CAS:61-54-1
Formula: C10H12N2
33682
NCCC1=CNC2=C1C=CC=C2
TRYPTAMINE-D4 (HYDROCHLORIDE)
CAS:340257-60-5
Formula: C10H8D4N2 • HCl
33538
NC([2H])([2H])C([2H])([2H])C1=CNC2=CC=CC=C12.Cl
TRYPTANTHRIN
CAS:13220-57-0
Formula: C15H8N2O2
17913
O=C1N2C(C(C3=C2C=CC=C3)=O)=NC4=C1C=CC=C4
TRYPTOPHOL
CAS:526-55-6
Formula: C10H11NO
28404
OCCC1=CNC2=CC=CC=C21
TRYPTOQUIVALINE D
CAS:60676-56-4
Formula: C28H28N4O7
33531
ON1[C@@]2([H])[C@]3(C[C@](N4C(C5=CC=CC=C5N=C4[C@H](C(C)C)OC(C)=O)=O)([H])C(O3)=O)C6=CC=CC=C6N2C([C@@H]1C)=O
TS 155-2
CAS:1314486-37-7
Formula: C39H60O11
20689
C[C@H]([C@]1(O)O[C@H](C(C)C)[C@@H](C)[C@H](OC(/C=C/C(O)=O)=O)C1)[C@H](O)[C@@H]([C@](OC(/C(C)=C/C(C)=C/[C@@H](C)[C@@H](O)[C@@H](C)C2)=O)([H])[C@H](/C=C/C=C2\C)OC)C
TS-011
CAS:339071-18-0
Formula: C11H14ClN3O2
9.00286e+006
ClC1=CC(N=CNO)=CC=C1N2CCOCC2
TSI-01
CAS:704878-75-1
Formula: C14H11Cl2NO4
17628
O=C(C(Cl)=C1Cl)N(C2=CC=C(C(OC(C)C)=O)C=C2)C1=O
TSPC
CAS:882286-32-0
Formula: C9H5N3O2S2
35837
N#CC1=NC=CN=C1S(=O)(C2=CC=CS2)=O
TT-232 (trifluoroacetate salt)
Formula: C45H58N10O9S2 • XCF3COOH
36045
O=C([C@@H](NC([C@H](CSSC[C@H](NC([C@@H](NC1=O)CCCCN)=O)C(N[C@H](C(N)=O)[C@H](O)C)=O)NC([C@H](N)CC2=CC=CC=C2)=O)=O)CC3=CC=C(C=C3)O)N[C@@H]1CC4=CNC5=CC=CC=C54.OC(C(F)(F)F)=O
TTAPE-Me
CAS:1219133-97-7
Formula: C46H68N4O4 • 4Br
36068
C[N+](C)(C)CCOC(C=C1)=CC=C1/C(C(C=C2)=CC=C2OCC[N+](C)(C)C)=C(C3=CC=C(C=C3)OCC[N+](C)(C)C)\C4=CC=C(C=C4)OCC[N+](C)(C)C.[Br-].[Br-].[Br-].[Br-]
TTK21
CAS:709676-56-2
Formula: C17H15ClF3NO2
21959
ClC1=CC=C(NC(C2=CC=CC=C2OCCC)=O)C=C1C(F)(F)F
TTNPB
CAS:71441-28-6
Formula: C24H28O2
16144
CC1(C)C2=C(C=CC(/C(C)=C/C3=CC=C(C(O)=O)C=C3)=C2)C(C)(C)CC1
TTP 22
CAS:329907-28-0
Formula: C16H14N2O2S2
17702
CC(C=C1)=CC=C1C2=CSC3=NC=NC(SCCC(O)=O)=C32
TUBACIN
CAS:537049-40-4
Formula: C41H43N3O7S
13691
O=C(CCCCCCC(NO)=O)NC(C=C1)=CC=C1[C@@H]2O[C@H](C3=CC=C(CO)C=C3)C[C@H](CSC4=NC(C5=CC=CC=C5)=C(C6=CC=CC=C6)O4)O2
TUBASTATIN A
CAS:1252003-15-8
Formula: C20H21N3O2
15785
ONC(C1=CC=C(CN2C(CCN(C)C3)=C3C4=C2C=CC=C4)C=C1)=O
TUBASTATIN A (TRIFLUOROACETATE SALT)
CAS:1239262-52-2
Formula: C20H21N3O2 • CF3COOH
10559
CN(C1)CCC2=C1C3=C(N2CC4=CC=C(C(NO)=O)C=C4)C=CC=C3.FC(F)(C(O)=O)F
TUBEIMOSIDE I
CAS:102040-03-9
Formula: C63H98O29
22276
CC1(C)CC[C@]23CC[C@@]4(C)[C@]5(C)CC[C@@]6([H])[C@@](CO)(C)[C@](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@]8([H])OC[C@H](OC(C[C@@](O)(C)CC(O[C@@H]9[C@@H](O[C@@]%10([H])[C@H](O)[C@@H](O)[C@H](O)CO%10)[C@@H](O)[C@H](O[C@@]%11([H])[C@H](OC3=O)OC[C@H](O)[C@
TUBERMYCIN B
CAS:2538-68-3
Formula: C13H8N2O2
33659
O=C(C1=C2N=C3C=CC=CC3=NC2=CC=C1)O
TUBEROSTEMONINE
CAS:6879-01-2
Formula: C22H33NO4
34457
CC[C@@H]1[C@]2([H])[C@]3([H])[C@@](C[C@]([C@]4([H])C[C@@H](C(O4)=O)C)([H])N3CCCC2)([H])[C@]5([H])[C@@]1([H])OC([C@H]5C)=O
TUCATINIB
CAS:937263-43-9
Formula: C26H24N8O2
31411
CC1=CC(NC2=C3C=C(NC4=NC(C)(C)CO4)C=CC3=NC=N2)=CC=C1OC5=CC6=NC=NN6C=C5
TUFTSIN (HUMAN) (TRIFLUOROACETATE SALT)
Formula: C21H40N8O6 • XCF3COOH
33804
C[C@@H](O)[C@H](N)C(N[C@@H](CCCCN)C(N1[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CCC1)=O)=O.OC(C(F)(F)F)=O
TUG-770
CAS:1402601-82-4
Formula: C19H14FNO2
22131
OC(CCC1=C(F)C=C(C#CC2=C(CC#N)C=CC=C2)C=C1)=O
TUG-891
CAS:1374516-07-0
Formula: C23H21FO3
17035
CC1=CC=C(C2=CC=C(F)C=C2COC3=CC=C(CCC(O)=O)C=C3)C=C1
TULATHROMYCIN A
CAS:217500-96-4
Formula: C41H79N3O12
19202
O=C1[C@H](C)[C@@H](O[C@@]2([H])C[C@](OC)(C)[C@@](CNCCC)(O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@]3([H])[C@H](O)[C@@H](N(C)C)C[C@@H](C)O3)[C@](C)(O)C[C@@H](C)CN[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)O1
Tulobuterol (hydrochloride)
CAS:56776-01-3
Formula: C12H18ClNO • HCl
35562
ClC1=C(C(CNC(C)(C)C)O)C=CC=C1.Cl
TUMULOSIC ACID
CAS:508-24-7
Formula: C31H50O4
36021
C[C@]12[C@@]([C@]([C@@H](CCC(C(C)C)=C)C(O)=O)([H])[C@@H](C1)O)(CCC3=C2CC[C@]4([H])[C@@]3(CC[C@@H](C4(C)C)O)C)C
TUNICAMYCIN 14:1 MIXTURE
Formula: C37H60N4O16
28355
CC(N[C@H]1[C@@H](O[C@@]2([H])[C@H](NC(/C=C/CCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@@H]3[C@@H](O)[C@@H](O)[C@H](N4C=CC(NC4=O)=O)O3)O2)O[C@H](CO)[C@@H](O)[C@@H]1O)=O
TUNICAMYCIN 15:1 MIXTURE
Formula: C38H62N4O16
28356
CC(N[C@H]1[C@@H](O[C@@]2([H])[C@H](NC(/C=C/CCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@@H]3[C@@H](O)[C@@H](O)[C@H](N4C=CC(NC4=O)=O)O3)O2)O[C@H](CO)[C@@H](O)[C@@H]1O)=O
TUNICAMYCIN 17:1 MIXTURE
Formula: C40H66N4O16
28358
CC(N[C@H]1[C@@H](O[C@@]2([H])[C@H](NC(/C=C/CCCCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@@H]3[C@@H](O)[C@@H](O)[C@H](N4C=CC(NC4=O)=O)O3)O2)O[C@H](CO)[C@@H](O)[C@@H]1O)=O
TUNR1
Formula: C39H66N4O16 (for TunR1 16:0)
31537
CC(N[C@H]1[C@@H](O[C@H]2[C@H](NC(CCCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@@H]3[C@@H](O)[C@@H](O)[C@H](N4C=CC(NC4=O)=O)O3)O2)O[C@H](CO)[C@@H](O)[C@@H]1O)=O.CC(N[C@H]5[C@@H](O[C@H]6[C@H](NC(CCCCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H
TUNR2
Formula: C39H68N4O16 (for TunR2 16:0)
31538
CC(N[C@H]1[C@@H](O[C@H]2[C@H](NC(CCCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@@H]3[C@@H](O)[C@@H](O)[C@H](N4CCC(NC4=O)=O)O3)O2)O[C@H](CO)[C@@H](O)[C@@H]1O)=O.CC(N[C@H]5[C@@H](O[C@H]6[C@H](NC(CCCCCCCCCCCC(C)C)=O)[C@@H](O)[C@@H](O)[C@@H](C[C@@H]
TURKESTERONE (HYDRATE)
Formula: C27H44O8 • XH2O
34665
O[C@]12C([C@@]([C@@H](C[C@@]1([C@]([C@@](C)(O)[C@H](O)CCC(C)(O)C)([H])CC2)C)O)([H])[C@@]3([C@@]4([H])C[C@H]([C@H](C3)O)O)C)=CC4=O.O
TVB-2640
CAS:1399177-37-7
Formula: C27H29N5O
35703
N#CC1=CC=C(C2CCN(CC2)C(C3=CC(C4=NN=C(C)N4[H])=C(C5CCC5)C=C3C)=O)C=C1
TVB-3166
CAS:1533438-83-3
Formula: C24H24N4O
33533
N#CC1=CC=C(C2CN(C2)C(C3=CC(C4=NNC(C)=C4C)=C(C)C=C3C)=O)C=C1
TW-37
CAS:877877-35-5
Formula: C33H35NO6S
20999
CC(C)(C)C1=C(S(C2=CC=C(NC(C3=C(O)C(O)=C(O)C(CC4=CC=CC=C4C(C)C)=C3)=O)C=C2)(=O)=O)C=CC=C1
TW9
CAS:2614417-90-0
Formula: C32H28ClN7O2S
31588
CC1=C(C)C(C(C2=CC=C(Cl)C=C2)=N[C@H]3CC(NC4=CC=C(C(NC5=C(N)C=CC=C5)=O)C=C4)=O)=C(S1)N6C3=NN=C6C
TWS119
CAS:601514-19-6
Formula: C18H14N4O2
1.00113e+007
Oc1cccc(c1)Oc1ncnc2[nH]c(cc12)c1cccc(N)c1
TX-1918
CAS:503473-32-3
Formula: C14H12O3
20840
CC1=C(O)C(C)=CC(/C=C2C(C=CC\2=O)=O)=C1
TX1-85-1
CAS:1603845-32-4
Formula: C32H36N8O3
19164
O=C(C=C)NC1=CC(C2=NN(C3CCC(N4CCN(C(C)=O)CC4)CC3)C5=NC=NC(N)=C52)=CC=C1OC6=CC=CC=C6
TY 52156
CAS:934369-14-9
Formula: C18H19Cl2N3O
19119
CC(C)(C)C(/C(NNC1=CC=C(Cl)C=C1)=N/C2=CC=C(Cl)C=C2)=O
TYLOSIN
CAS:1401-69-0
Formula: C46H77NO17
22599
O=C(/C=C/C(C)=C\[C@H](CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]1OC)[C@@H](CC)O2)[C@H](C)CC(CC=O)[C@H](O[C@]3([H])O[C@H](C)[C@@H](O[C@@]4([H])C[C@@](C)(O)[C@@H](O)[C@H](C)O4)[C@H](N(C)C)[C@H]3O)[C@@H](C)[C@H](O)CC2=O
TYLVALOSIN (TARTRATE)
CAS:63428-13-7
Formula: C53H87NO19 • XC4H6O6
33849
OC([C@H](O)[C@@H](O)C(O)=O)=O.CN(C)[C@H]([C@H]([C@@H](O[C@@H]1C)O[C@H]2[C@H](C[C@H](C(/C=C/C(C)=C/[C@@H]([C@H](OC(C[C@H]([C@@H]2C)OC(C)=O)=O)CC)CO[C@H]3[C@@H]([C@@H]([C@@H]([C@H](O3)C)O)OC)OC)=O)C)CC=O)O)[C@@H]1O[C@H]4C[C@@](O)([C@H]([C@@H](O4)C)OC(CC(C)C
TYPHANEOSIDE
CAS:104472-68-6
Formula: C34H42O20
38970
O=C(C(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)O)O)O)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)O)O)O)=C(C4=CC(OC)=C(C=C4)O)OC5=CC(O)=C6)C5=C6O
TYR-A-CGRP (HUMAN) (TRIFLUOROACETATE SALT)
CAS:124756-98-5
Formula: C172H276N52O51S2 • XCF3COOH
24724
NC([C@@H](NC([C@@H](NC([C@H](CCCCN)NC([C@H](CO)NC(CNC([C@H](C(C)C)NC([C@H](CC(N)=O)NC([C@@]([C@@H](C)O)([H])NC([C@@H]1CCCN1C([C@H](C(C)C)NC([C@@H](NC([C@H](CC(N)=O)NC([C@H](CC(N)=O)NC([C@H](CCCCN)NC([C@H](C(C)C)NC([C@H](C(C)C)NC(CNC(CNC([C@H](CO)NC([C@H](
TYR-A-CGRP (RAT) (TRIFLUOROACETATE SALT)
Formula: C171H271N51O54S2 • XCF3COOH
24729
NC([C@@H](NC([C@@H](NC([C@H](CCC(O)=O)NC([C@H](CO)NC(CNC([C@H](C(C)C)NC([C@H](CC(N)=O)NC([C@@]([C@@H](C)O)([H])NC([C@@H]1CCCN1C([C@H](C(C)C)NC([C@@H](NC([C@H](CC(N)=O)NC([C@@H](NC([C@H](CCCCN)NC([C@H](C(C)C)NC([C@H](C(C)C)NC(CNC(CNC([C@H](CO)NC([C@H](CCCN
Tyr-ß-CGRP (human) (trifluoroacetate salt)
Formula: C171H276N52O50S3 • XCF3COOH
24766
NC([C@H](CC1=CC=CC=C1)NC([C@H](C)NC([C@@H](NC([C@@H](NC(CNC([C@@H](NC([C@@H](NC([C@@]([H])(NC([C@@H]2CCCN2C([C@@H](NC([C@H](CC3=CC=CC=C3)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CCSC)NC(CNC(CNC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC(CNC
TYRAMINE
CAS:51-67-2
Formula: C8H11NO
18601
OC1=CC=C(CCN)C=C1
TYRAMINE-D4 (HYDROCHLORIDE)
CAS:1189884-47-6
Formula: C8H7D4NO • HCl
28531
OC1=CC=C(C([2H])([2H])C([2H])([2H])N)C=C1.Cl
TYROCIDINE COMPLEX
CAS:8011-61-8
Formula: C66H87N13O13 (for A)
25655
O=C(N1CCC[C@]1(C(N[C@@H](CC2=CC=CC=C2)C(N[C@]([H])(CC3=CC=CC=C3)C(N[C@@H](CC(N)=O)C(N[C@H]4CCC(N)=O)=O)=O)=O)=O)[H])[C@@]([H])(CC5=CC=CC=C5)NC([C@H](CC(C)C)NC([C@]([H])(CCCN)NC([C@H](C(C)C)NC([C@H](CC6=CC=C(C=C6)O)NC4=O)=O)=O)=O)=O.O=C(N7CCC[C@]7(C(N[C@@H
TYROSOL
CAS:501-94-0
Formula: C8H10O2
27600
OC1=CC=C(CCO)C=C1
TYROTHRICIN
CAS:1404-88-2
Formula: C66H87N13O13 (for Tyrocidine A)
22177
O=C(N1CCC[C@]1(C(N[C@@H](CC2=CC=CC=C2)C(N[C@]([H])(CC3=CC=CC=C3)C(N[C@@H](CC(N)=O)C(N[C@H]4CCC(N)=O)=O)=O)=O)=O)[H])[C@@]([H])(CC5=CC=CC=C5)NC([C@H](CC(C)C)NC([C@]([H])(CCCN)NC([C@H](C(C)C)NC([C@H](CC6=CC=C(C=C6)O)NC4=O)=O)=O)=O)=O.O=C(N[C@@H](C)C(N[C@H](
TYVELOSE
CAS:5658-12-8
Formula: C6H12O4
20910
O=C[C@H](C[C@@H]([C@@H](C)O)O)O
TZ9
CAS:1002789-86-7
Formula: C17H14N6O4
15964
NC1=NC(COC(C2=CC=C([N+]([O-])=O)C=C2)=O)=NC(NC3=CC=CC=C3)=N1
U-0124
CAS:108923-79-1
Formula: C8H10N4S2
34871
N#CC(C(C#N)=C(N)SC)=C(N)SC
U-0126
CAS:109511-58-2
Formula: C18H16N6S2
70970
N/C(SC1=CC=CC=C1N)=C(C#N)\C(C#N)=C(N)\SC2=C(N)C=CC=C2
U-0521
CAS:5466-89-7
Formula: C10H12O3
36314
O=C(C(C)C)C1=CC=C(C(O)=C1)O
U-104
CAS:178606-66-1
Formula: C13H12FN3O3S
16717
FC1=CC=C(NC(NC2=CC=C(S(N)(=O)=O)C=C2)=O)C=C1
U-18666A
CAS:3039-71-2
Formula: C25H41NO2 • HCl
1.00091e+007
C[C@]12C(C[C@@H](OCCN(CC)CC)CC2)=CC[C@]3([H])[C@]1([H])CC[C@@]4(C)[C@@]3([H])CCC4=O.Cl
U-47109
CAS:67579-13-9
Formula: C15H20Cl2N2O
21663
ClC1=C(C=CC(C(N[C@@H]2CCCC[C@H]2N(C)C)=O)=C1)Cl
U-47931E
CAS:67579-24-2
Formula: C15H21BrN2O
20530
BrC1=CC=C(C(N[C@@H]2CCCC[C@H]2N(C)C)=O)C=C1
U-48520
CAS:67579-11-7
Formula: C16H23ClN2O
26274
ClC1=CC=C(C(N(C)[C@@H]2CCCC[C@H]2N(C)C)=O)C=C1
U-48753E (MALEATE)
CAS:67450-45-7
Formula: C16H22Cl2N2O • C4H4O4
20734
ClC1=C(Cl)C=CC(N(C(CC)=O)[C@@H]2CCC[C@H]2N(C)C)=C1.OC(/C=C\C(O)=O)=O
U-62066 (MESYLATE)
CAS:87173-97-5
Formula: C22H30Cl2N2O2 • CH3SO3H
25072
ClC1=C(Cl)C=CC(CC(N(C)[C@H]2CC[C@]3(OCCC3)C[C@@H]2N4CCCC4)=O)=C1.CS(O)(=O)=O
U-69593
Formula: C22H32N2O2
13255
O=C(N(C)[C@H]1CC[C@]2(OCCC2)C[C@@H]1N3CCCC3)CC4=CC=CC=C4
U-73122
CAS:112648-68-7
Formula: C29H40N2O3
70740
[H][C@@]12CCC3=CC(OC)=CC=C3[C@@]1([H])CC[C@@]4(C)[C@@]2([H])CC[C@@H]4N(CCCCCCN5C(C=CC5=O)=O)[H]
U-73343
CAS:142878-12-4
Formula: C29H42N2O3
17339
COC1=CC=C2C(CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4NCCCCCCN5C(CCC5=O)=O)=C1
U-74389G
CAS:153190-29-5
Formula: C37H50N6O2 • C4H4O4
75860
C[C@@]12[C@](CC[C@@H]2C(CN3CCN(C4=CC(N5CCCC5)=NC(N6CCCC6)=N4)CC3)=O)([H])[C@](C7=CC1)([H])CCC([C@]7(C)C=C8)=CC8=O.OC(/C=C\C(O)=O)=O
U-92016A
CAS:149654-41-1
Formula: C19H25N3 • HCl
23807
CCCN(CCC)[C@@H](C1)CCC2=C1C(C=C(C#N)N3)=C3C=C2.Cl
U-93631
CAS:152273-12-6
Formula: C17H21N3O2
26417
CC1(C)C2=C(C(OC(C)(C)C)=O)N=CN2C3=C(C=CC=C3)N1
U-99194 (maleate)
CAS:234757-41-6
Formula: C17H27NO2 • C4H4O4
35854
OC(/C=C\C(O)=O)=O.CCCN(C1CC2=CC(OC)=C(OC)C=C2C1)CCC
UAMC 0039 (HYDROCHLORIDE)
CAS:697797-51-6
Formula: C16H24ClN3O • 2HCl
15340
O=C([C@@H](N)CCNCC1=CC=C(Cl)C=C1)N2CCCCC2.Cl.Cl
UAMC-3203
CAS:2271358-64-4
Formula: C25H37N5O2S
26525
O=S(C(C=C1NCC2=CC=CC=C2)=CC=C1NC3CCCCC3)(NCCN4CCNCC4)=O
UAMC-3203 (HYDROCHLORIDE)
CAS:2271358-65-5
Formula: C25H37N5O2S • HCl
29346
O=S(C(C=C1NCC2=CC=CC=C2)=CC=C1NC3CCCCC3)(NCCN4CCNCC4)=O.Cl
UBIQUINOL
CAS:992-78-9
Formula: C59H92O4
19677
COC1=C(OC)C(O)=C(C/C=C(C)/CC/C=C(C)/CC/C=C(C)/CC/C=C(C)/CC/C=C(C)/CC/C=C(C)\CC/C=C(CC/C=C(C)/CC/C=C(C)/CC/C=C(C)\C)\C)C(C)=C1O
UBIQUITIN ISOPEPTIDASE INHIBITOR I
CAS:108477-18-5
Formula: C19H14N2O7S
21006
O=C(/C(CS(C/1)(=O)=O)=C\C2=CC=C([N+]([O-])=O)C=C2)C1=C/C3=CC=C([N+]([O-])=O)C=C3
UBP 301
CAS:569371-10-4
Formula: C15H14IN3O6
17597
OC([C@@H](N)CN1C=C(I)C(N(CC2=CC=C(C(O)=O)C=C2)C1=O)=O)=O
UBP 302
CAS:745055-91-8
Formula: C15H15N3O6
24309
O=C(O)C1=CC=CC=C1CN2C(N(C[C@H](N)C(O)=O)C=CC2=O)=O
UBP 310
CAS:902464-46-4
Formula: C14H15N3O6S
21806
O=C(N(C[C@H](N)C(O)=O)C=C1C)N(CC2=C(C(O)=O)SC=C2)C1=O
UC2288
CAS:1394011-91-6
Formula: C20H18ClF6N3O2
37380
FC(F)(F)C(C=N1)=CC=C1O[C@@H]2CC[C@H](CC2)NC(NC3=CC(C(F)(F)F)=C(C=C3)Cl)=O
UCB 9260
CAS:1515888-53-5
Formula: C26H25N5O
37336
OC(C1=NC2=C(N1CC3=CC(C)=CC=C3C)C=C(C4=CN(C)N=C4)C=C2)C5=CC=NC=C5
UCL-TRO-1938
CAS:2919575-27-0
Formula: C27H32N6O
39118
CCN(CC1)CCN1C(C=C2)=CC=C2NC3=CC(NC4=CC=CC5=C4N(C(C)=O)CC5)=CC=N3
UCLA GP130 2
CAS:339303-87-6
Formula: C15H11FN2S
35551
FC1=CC=C(NC2=NC(C3=CC=CC=C3)=CS2)C=C1
UCM05
CAS:1094451-90-7
Formula: C24H16O10
19090
OC1=C(O)C(O)=CC(C(OC2=CC(C=CC=C3)=C3C(OC(C4=CC(O)=C(O)C(O)=C4)=O)=C2)=O)=C1
UCM53
CAS:2468847-23-4
Formula: C24H14Cl2O6
21768
ClC1=C(O)C=CC(C(OC2=CC(C=CC=C3)=C3C(OC(C4=CC(Cl)=C(O)C=C4)=O)=C2)=O)=C1
UCPH-101
CAS:1118460-77-7
Formula: C27H22N2O3
21460
COC(C=C1)=CC=C1C2C(C#N)=C(N)OC3=C2C(C[C@@H](C4=C(C=CC=C5)C5=CC=C4)C3)=O
UDENAFIL
CAS:268203-93-6
Formula: C25H36N6O4S
30373
CCCOC1=CC=C(S(NCCC2N(C)CCC2)(=O)=O)C=C1C(NC3=C4N(C)N=C3CCC)=NC4=O
UDP (SODIUM SALT HYDRATE)
Formula: C9H12N2O12P2 • 2Na [XH2O]
18137
OP(OP(OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C=CC(NC2=O)=O)O1)([O-])=O)([O-])=O.[Na+].[Na+].O
UDP-A-D-GALACTOSE (SODIUM SALT)
CAS:137868-52-1
Formula: C15H22N2O17P2 • 2Na
34664
O[C@H]1[C@@](N2C(NC(C=C2)=O)=O)([H])O[C@@H]([C@H]1O)COP(OP(O[C@H]3O[C@@H]([C@@H]([C@@H]([C@H]3O)O)O)CO)([O-])=O)([O-])=O.[Na+].[Na+]
UDP-A-D-GLUCOSE (SODIUM SALT HYDRATE)
Formula: C15H22N2O17P2 • 2Na [XH2O]
15602
O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(OP(OC[C@@H]2[C@@H](O)[C@@H](O)[C@H](N3C=CC(NC3=O)=O)O2)([O-])=O)([O-])=O)[C@@H]1O.[Na+].[Na+].O
UDP-GalNAc (sodium salt)
CAS:108320-87-2
Formula: C17H25N3O17P2 • 2Na
36506
O[C@H]1[C@@](N2C(NC(C=C2)=O)=O)([H])O[C@@H]([C@H]1O)COP(OP(O[C@H]3O[C@@H]([C@@H]([C@@H]([C@H]3NC(C)=O)O)O)CO)([O-])=O)([O-])=O.[Na+].[Na+]
UDP-GLUCURONIC ACID (SODIUM SALT HYDRATE)
Formula: C15H19N2O18P2 • 3Na [XH2O]
20674
O=P(OP(OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C=CC(NC2=O)=O)O1)([O-])=O)([O-])O[C@H]3O[C@H](C([O-])=O)[C@@H](O)[C@H](O)[C@H]3O.[Na+].[Na+].[Na+]
UDP-N-ACETYL-D-GLUCOSAMINE (SODIUM SALT HYDRATE)
Formula: C17H25N3O17P2 • 2Na [XH2O]
20353
O=P(OP(OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C=CC(NC2=O)=O)O1)([O-])=O)([O-])O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O.[Na+].[Na+].O
UDP-ß-D-Glucose (sodium salt)
CAS:7333-33-7
Formula: C15H22N2O17P2 • 2Na
21620
O=P(OP(OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C=CC(NC2=O)=O)O1)([O-])=O)([O-])O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O.[Na+].[Na+]
UDP-ß-S (sodium salt)
Formula: C9H11N2O11P2S • 3Na
38493
O=C(N(C=C1)[C@H]2[C@H](O)[C@H](O)[C@@H](COP([O-])(OP([S-])([O-])=O)=O)O2)NC1=O.[Na+].[Na+].[Na+]
UF-17 (HYDROCHLORIDE)
Formula: C17H26N2O • HCl
27925
CN(C)[C@H]1[C@H](N(C(CC)=O)C2=CC=CC=C2)CCCC1.Cl
UF010
CAS:537672-41-6
Formula: C11H15BrN2O
21273
BrC1=CC=C(C(NNCCCC)=O)C=C1
UFP101 (trifluoroacetate salt)
Formula: C82H138N32O21 • XCF3COOH
36833
NC(CC[C@@H](C(N)=O)NC([C@H](CC(N)=O)NC([C@H](CCCCN)NC([C@H](CCCNC(N)=N)NC([C@H](CCCCN)NC([C@H](CCCNC(N)=N)NC([C@H](C)NC([C@H](CO)NC([C@H](CCCCN)NC([C@H](CCCNC(N)=N)NC([C@H](C)NC(CNC([C@H]([C@H](O)C)NC([C@@H](NC(CNC(CNC(CNCC1=CC=CC=C1)=O)=O)=O)CC2=CC=CC=C2
UGT8 INHIBITOR 19
CAS:2414349-93-0
Formula: C20H22F6N4O4S
32723
CNC(C(C1=NC(N2CCC(CC2)OC(N[C@@H](C)COC(F)(F)F)=O)=C3)=CSC1=C3C(F)(F)F)=O
UK 1
CAS:151271-53-3
Formula: C22H14N2O5
20139
OC(C=CC=C1)=C1C2=NC3=C(C=CC=C3C4=NC5=C(C=CC=C5C(OC)=O)O4)O2
UK 122 (trifluoroacetate salt)
CAS:1186653-73-5
Formula: C17H13N3O2 • CF3COOH
9.00122e+006
NC(C1=CC=C(/C=C2N=C(C3=CC=CC=C3)OC/2=O)C=C1)=N.OC(C(F)(F)F)=O
UK 356618
CAS:230961-08-7
Formula: C34H43N3O4
32859
CC1=C(C2=CC=CC=C2)C=CC(CCC[C@H](CC(NO)=O)C(N[C@@H](C(C)(C)C)C(N[C@@H](C3=CC=CC=C3)C)=O)=O)=C1
UK 371804
CAS:256477-09-5
Formula: C14H16ClN5O4S
27225
ClC1=CN=C(NC(N)=N)C2=C1C=CC(S(NC(C)(C)C(O)=O)(=O)=O)=C2
UK 5099
CAS:56396-35-1
Formula: C18H12N2O2
16980
O=C(/C(C#N)=C/C(C1=C2C=CC=C1)=CN2C3=CC=CC=C3)O
ULIPRISTAL ACETATE
CAS:126784-99-4
Formula: C30H37NO4
23657
CN(C)C(C=C1)=CC=C1[C@H]2C[C@@]3(C)[C@](CC[C@]3(OC(C)=O)C(C)=O)([H])[C@]4([H])CCC5=CC(CCC5=C42)=O
ULIPRISTAL ACETATE-D6
CAS:1621894-64-1
Formula: C30H31D6NO4
26446
O=C1CCC2=C3[C@@]([C@@](CC[C@]4(OC(C)=O)C(C)=O)([H])[C@]4(C)C[C@@H]3C5=CC=C(N(C([2H])([2H])[2H])C([2H])([2H])[2H])C=C5)([H])CCC2=C1
ULIXERTINIB (HYDROCHLORIDE)
CAS:1956366-10-1
Formula: C21H22Cl2N4O2 • HCl
18298
CC(C)NC1=CC(C2=CNC(C(N[C@H](CO)C3=CC(Cl)=CC=C3)=O)=C2)=C(Cl)C=N1.Cl
ULK-101
CAS:2443816-45-1
Formula: C22H16F4N4OS
40403
O=C(C1=CC(C(C=N2)=C3N2C=C(C(C=C4)=CC=C4F)C=N3)=CS1)N[C@@H](C5CC5)C(F)(F)F
UM-164
CAS:903564-48-7
Formula: C30H31F3N8O3S
26188
O=C(NC1=CC=C(C)C(NC(C2=CN=C(NC3=NC(C)=NC(N4CCN(CCO)CC4)=C3)S2)=O)=C1)C5=CC(C(F)(F)F)=CC=C5
UMB-32
CAS:1635437-39-6
Formula: C21H23N5O
17123
CC(C)(C)NC1=C(N=C2N1C=CN=C2)C3=CC=C(C4=C(C)ON=C4C)C=C3
UMBELLIFERONE
CAS:93-35-6
Formula: C9H6O3
24665
OC1=CC=C(C=CC(O2)=O)C2=C1
UMBELLIPRENIN
CAS:532-16-1
Formula: C24H30O3
27894
C/C(C)=C/CC/C(C)=C/CC/C(C)=C/COC1=CC=C(C=CC(O2)=O)C2=C1
UMECLIDINIUM (BROMIDE)
CAS:869113-09-7
Formula: C29H34NO2 • Br
20700
OC(C1=CC=CC=C1)(C2=CC=CC=C2)C34CC[N+](CC4)(CCOCC5=CC=CC=C5)CC3.[Br-]
UMI-77
CAS:518303-20-3
Formula: C18H14BrNO5S2
19148
OC1=C(SCC(O)=O)C=C(NS(C2=CC=C(Br)C=C2)(=O)=O)C3=CC=CC=C31
UMIFENOVIR (HYDROCHLORIDE)
CAS:131707-23-8
Formula: C22H25BrN2O3S • HCl
16933
CN1C(CSC2=CC=CC=C2)=C(C(OCC)=O)C3=C(CN(C)C)C(O)=C(Br)C=C31.Cl
UMIFENOVIR-D6 (HYDROCHLORIDE)
CAS:2928218-29-3
Formula: C22H19D6BrN2O3S • HCl
31494
CN1C(CSC2=CC=CC=C2)=C(C(OCC)=O)C3=C(CN(C([2H])([2H])[2H])C([2H])([2H])[2H])C(O)=C(Br)C=C31.Cl
UMIROLIMUS
CAS:851536-75-9
Formula: C55H87NO14
23585
O=C([C@]1([H])CCCCN1C(C([C@@]2(O)[C@H](C)CC[C@](C[C@H](OC)/C(C)=C/C=C/C=C/[C@H](C3)C)([H])O2)=O)=O)O[C@](CC([C@H](C)/C=C(C)/[C@@H](O)[C@@H](OC)C([C@@H]3C)=O)=O)([H])[C@H](C)C[C@@H]4CC[C@@H](OCCOCC)[C@H](OC)C4
UNBS5162
CAS:956590-23-1
Formula: C17H18N4O3
17739
O=C(C1=CC(NC(N)=O)=CC2=C1C3=CC=C2)N(CCN(C)C)C3=O
UNC0064-12
CAS:1430089-64-7
Formula: C19H24N8
33555
NCCCNC(C=C1)=CC=C1NC2=NC=CC(NC3=NNC(C4CC4)=C3)=N2
UNC0224
CAS:1197196-48-7
Formula: C26H43N7O2
13631
COC1=CC2=C(NC3CCN(C)CC3)N=C(N4CCN(C)CCC4)N=C2C=C1OCCCN(C)C
UNC0379
CAS:1620401-82-2
Formula: C23H35N5O2
16400
COC1=C(OC)C=C(N=C(N2CCCC2)N=C3NCCCCCN4CCCC4)C3=C1
UNC0631
CAS:1320288-19-4
Formula: C37H61N7O2
11084
CC(C)N(CCC1)CCN1C2=NC(C=C(OCCCN3CCCCC3)C(OC)=C4)=C4C(NC(CC5)CCN5CC6CCCCC6)=N2
UNC0638
CAS:1255580-76-7
Formula: C30H47N5O2
10734
CC(C)N(CC1)CCC1NC2=NC(C3CCCCC3)=NC4=CC(OCCCN5CCCC5)=C(OC)C=C42
UNC0642
CAS:1481677-78-4
Formula: C29H44F2N6O2
14604
COC1=CC2=C(NC3CCN(C(C)C)CC3)N=C(N4CCC(F)(F)CC4)N=C2C=C1OCCCN5CCCC5
UNC0646
CAS:1320288-17-2
Formula: C36H59N7O2
11085
CC(C)N(CCC1)CCN1C2=NC(C=C(OCCCN3CCCCC3)C(OC)=C4)=C4C(NC(CC5)CCN5C6CCCCC6)=N2
UNC1079
CAS:1418741-86-2
Formula: C28H42N4O2
20566
O=C(C1=CC=C(C(N2CCC(N3CCCCC3)CC2)=O)C=C1)N(CC4)CCC4N5CCCCC5
UNC1215
CAS:1415800-43-9
Formula: C32H43N5O2
13968
O=C(N1CCC(N2CCCC2)CC1)C3=CC=C(C(N4CCC(N5CCCC5)CC4)=O)C=C3NC6=CC=CC=C6
UNC1999
CAS:1431612-23-5
Formula: C33H43N7O2
14621
CC(C)N1C2=CC(C3=CC=C(N4CCN(C(C)C)CC4)N=C3)=CC(C(NCC5=C(CCC)C=C(C)NC5=O)=O)=C2C=N1
UNC2025
CAS:1429881-91-3
Formula: C28H40N6O
16613
CCCCNC1=NC=C2C(N([C@@H]3CC[C@@H](O)CC3)C=C2C4=CC=C(CN5CCN(C)CC5)C=C4)=N1
UNC2170 (MALEATE)
CAS:2173992-60-2
Formula: C14H21BrN2O • C4H4O4
17374
BrC1=CC=CC(C(NCCCNC(C)(C)C)=O)=C1.OC(/C=C\C(O)=O)=O
UNC2250
CAS:1493694-70-4
Formula: C24H36N6O2
17703
CCCCNC1=NC=C(C2=NC=C(CN3CCOCC3)C=C2)C(N[C@@H]4CC[C@@H](O)CC4)=N1
UNC2327
CAS:1426152-53-5
Formula: C14H17N5O2S
18122
O=C(CNC(NC1=CC=C(N=NS2)C2=C1)=O)N3CCCCC3
UNC2881
CAS:1493764-08-1
Formula: C25H33N7O2
29012
O[C@H]1CC[C@H](NC2=NC(NCCCC)=NC=C2C(NCC3=CC=C(N4C=NC=C4)C=C3)=O)CC1
UNC3230
CAS:1031602-63-7
Formula: C17H20N4O2S
16401
O=C(C1CCCCC1)NC2=C(C(N)=O)N=C(S2)NC3=CC=CC=C3
UNC3866
CAS:1872382-47-2
Formula: C43H66N6O8
19237
CC(C)(C1=CC=C(C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(OC)=O)CO)=O)CCCCN(CC)CC)=O)CC(C)C)=O)C)=O)CC2=CC=CC=C2)=O)C=C1)C
UNC569
CAS:1350547-65-7
Formula: C22H29FN6
22966
CCCCNC1=NC=C2C(N(C[C@H]3CC[C@H](N)CC3)N=C2C4=CC=C(F)C=C4)=N1
UNC669
CAS:1314241-44-5
Formula: C15H20BrN3O
10875
BrC1=CN=CC(C(N2CCC(N3CCCC3)CC2)=O)=C1
UNC6934
CAS:2561494-77-5
Formula: C24H21N5O4
28814
O=C(N1)COC2=C1C=CC(C(N(C3CC3)CC4=CC=C(C(NC5=NC=NC=C5)=O)C=C4)=O)=C2
UNC7145
CAS:2561494-78-6
Formula: C24H23N5O4
40166
O=C(C1=CC=C2NC(COC2=C1)=O)N(CC3=CC=C(C(NC4=NC=NC=C4)=O)C=C3)C(C)C
UNC8153 (trifluoroacetate salt)
CAS:2929304-61-8
Formula: C33H37N5O5 • CF3COOH
38932
O=C1COC2=C(C=CC(C(N(C3CC3)CC4=CC=C(C(NC5=CC=C(C(NCCCCCCN)=O)C=C5)=O)C=C4)=O)=C2)N1.OC(C(F)(F)F)=O
UNC926
CAS:1184136-10-4
Formula: C16H21BrN2O
27302
BrC1=CC=CC(C(N2CCC(N3CCCC3)CC2)=O)=C1
UNDECANEDIOIC ACID
CAS:1852-04-6
Formula: C11H20O4
36465
O=C(CCCCCCCCCC(O)=O)O
UNDECANOIC ACID
CAS:112-37-8
Formula: C11H22O2
19721
OC(CCCCCCCCCC)=O
UNDECANOIC ACID METHYL ESTER
CAS:1731-86-8
Formula: C12H24O2
26720
O=C(CCCCCCCCCC)OC
UNGEREMINE
CAS:2121-12-2
Formula: C16H12NO3
34549
OC1=CC2=C(C(CC3)=C1)[N+]3=CC4=CC5=C(OCO5)C=C24
UNGUINOL
CAS:36587-59-4
Formula: C19H18O5
24207
CC1=C2C(OC(C=C(O)C=C3C)=C3C(O2)=O)=C(/C(C)=C/C)C=C1O
UNGUISIN A
CAS:226956-06-5
Formula: C40H54N8O7
23878
O=C(NCCCC(N[C@H](C)C1=O)=O)[C@@H](CC2=CNC3=CC=CC=C32)NC([C@@H](C)NC([C@](C(C)C)([H])NC([C@H](CC4=CC=CC=C4)NC([C@@H](C(C)C)N1)=O)=O)=O)=O
UNGUISIN B
CAS:226956-07-6
Formula: C37H56N8O7
25115
O=C(NCCCC(N[C@H](C)C1=O)=O)[C@@H](CC2=CNC3=CC=CC=C32)NC([C@@H](C)NC([C@](C(C)C)([H])NC([C@H](CC(C)C)NC([C@@H](C(C)C)N1)=O)=O)=O)=O
UNICONAZOLE
CAS:83657-22-1
Formula: C15H18ClN3O
17852
ClC1=CC=C(/C=C(C(O)C(C)(C)C)/N2N=CN=C2)C=C1
UNIFIRAM
CAS:272786-64-8
Formula: C13H15FN2O3S
34209
O=C1N2CCN(S(=O)(C3=CC=C(C=C3)F)=O)CC2CC1
UOS 12258
CAS:875927-64-3
Formula: C17H19FN2O2S
36571
CC(C)S(N[C@@H]1CC2=CC(C3=CN=C(F)C=C3)=CC=C2C1)(=O)=O
UPADACITINIB
CAS:1310726-60-3
Formula: C17H19F3N6O
29706
CC[C@H](CN(C(NCC(F)(F)F)=O)C1)[C@@]1([H])C2=CN=C3C=NC4=C(C=CN4)N32
UPF-1069
CAS:1048371-03-4
Formula: C17H13NO3
17760
O=C1NC=CC2=C(OCC(C3=CC=CC=C3)=O)C=CC=C21
UPF-648
CAS:213400-34-1
Formula: C11H8Cl2O3
32860
O=C(C1=CC(Cl)=C(C=C1)Cl)[C@@H]2[C@H](C2)C(O)=O
UPROSERTIB
CAS:1047634-65-0
Formula: C18H16Cl2F2N4O2
19904
FC1=CC=C(C[C@@H](CN)NC(C2=CC(C3=C(Cl)C=NN3C)=C(Cl)O2)=O)C=C1F
UR-144 N-(2-HYDROXYPENTYL) METABOLITE
CAS:2748288-94-8
Formula: C21H29NO2
14470
O=C(C1C(C)(C)C1(C)C)C2=CN(CC(O)CCC)C3=C2C=CC=C3
UR-144 N-(4-HYDROXYPENTYL) METABOLITE
CAS:1537889-04-5
Formula: C21H29NO2
11774
O=C(C1C(C)(C)C1(C)C)C2=CN(CCCC(O)C)C3=C2C=CC=C3
UR-144 N-(4-HYDROXYPENTYL) METABOLITE-D5
CAS:2747917-78-6
Formula: C21H24D5NO2
14374
O=C(C1C(C)(C)C1(C)C)C2=C([2H])N(CCCC(O)C)C3=C2C([2H])=C([2H])C([2H])=C3[2H]
UR-144 N-(5-BROMOPENTYL) ANALOG
CAS:1628690-26-5
Formula: C21H28BrNO
12003
O=C(C1=CN(CCCCCBr)C2=C1C=CC=C2)C3C(C)(C)C3(C)C
UR-144 N-(5-CHLOROPENTYL) ANALOG
CAS:1445577-42-3
Formula: C21H28CLNO
11951
O=C(C1C(C)(C)C1(C)C)C2=CN(CCCCCCl)C3=C2C=CC=C3
UR-144 N-(5-Hydroxypentyl) ß-D-Glucuronide
CAS:1630023-01-6
Formula: C27H37NO8
11776
O=C(C1C(C)(C)C1(C)C)C2=CN(CCCCCO[C@@H]3O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C4=C2C=CC=C4
UR-144 N-(5-METHYLHEXYL) ANALOG
Formula: C23H33NO
9.00144e+006
CC(C)CCCCN1C=C(C(C2C(C)(C)C2(C)C)=O)C3=C1C=CC=C3
UR-144 N-HEPTYL ANALOG
CAS:1616469-06-7
Formula: C23H33NO
14231
O=C(C1C(C)(C)C1(C)C)C2=CN(CCCCCCC)C3=C2C=CC=C3
UR-144 N-PENTANOIC ACID METABOLITE
CAS:1451369-33-7
Formula: C21H27NO3
11773
O=C(C1C(C)(C)C1(C)C)C2=CN(CCCCC(O)=O)C3=C2C=CC=C3
UR-144 N-PENTANOIC ACID METABOLITE-D5
CAS:2117405-23-7
Formula: C21H22D5NO3
14376
O=C(C1C(C)(C)C1(C)C)C2=C([2H])N(CCCCC(O)=O)C3=C2C([2H])=C([2H])C([2H])=C3[2H]
URACIL
CAS:66-22-8
Formula: C4H4N2O2
26088
O=C(NC=C1)NC1=O
URACIL-13C,15N2
CAS:181517-11-3
Formula: C3[13C]H4[15N]2O2
33997
O=[13C]([15NH]1)[15NH]C=CC1=O
URACIL-D4
CAS:24897-55-0
Formula: C4D4N2O2
36318
O=C1N([2H])C(N([2H])C([2H])=C1[2H])=O
URAPIDIL (HYDROCHLORIDE)
CAS:64887-14-5
Formula: C20H29N5O3 • HCl
29004
COC1=CC=CC=C1N2CCN(CCCNC3=CC(N(C)C(N3C)=O)=O)CC2.Cl
URB447
CAS:1132922-57-6
Formula: C25H21ClN2O
13261
ClC1=CC=C(CN2C(C)=C(C(C3=CC=CC=C3)=O)C(N)=C2C4=CC=CC=C4)C=C1
URB597
CAS:546141-08-6
Formula: C20H22N2O3
10046
O=C(NC1CCCCC1)Oc1cccc(c1)c1cccc(c1)C(=O)N
URB602
CAS:565460-15-3
Formula: C19H21NO2
1.00075e+007
O=C(OC1CCCCC1)Nc1cccc(c1)c1ccccc1
URB754
CAS:86672-58-4
Formula: C16H14N2O2
1.00077e+007
Cc1ccc(cc1)Nc1nc2ccc(C)cc2c(=O)o1
URB937
CAS:1357160-72-5
Formula: C20H22N2O4
10674
NC(C1=CC(C2=C(O)C=CC(OC(NC3CCCCC3)=O)=C2)=CC=C1)=O
URDAMYCIN A
CAS:98474-21-6
Formula: C43H56O17
29510
O[C@@H]1C[C@H](O[C@H]2CC[C@H](O[C@H]3[C@H](O)[C@@H](C)O[C@](C4=C(O)C(C(C(C=C[C@@](C[C@](O)(C)C5)(O)[C@]6(O[C@H]7CC[C@H](O)[C@H](C)O7)C5=O)=C6C8=O)=O)=C8C=C4)([H])C3)O[C@H]2C)O[C@H](C)[C@H]1O
URDAMYCIN B
CAS:104542-46-3
Formula: C37H44O13
29770
O[C@@H]1C[C@H](O[C@H]2CC[C@H](O[C@H]3[C@H](O)[C@@H](C)O[C@](C4=C(O)C(C(C(C=CC(C[C@](O)(C)C5)=C6C5=O)=C6C7=O)=O)=C7C=C4)([H])C3)O[C@H]2C)O[C@H](C)[C@H]1O
UREIDOSUCCINIC ACID
CAS:923-37-5
Formula: C5H8N2O5
34126
O=C(NC(CC(O)=O)C(O)=O)NO=C(NC(CC(O)=O)C(O)=O)N
URIC ACID (SODIUM SALT)
CAS:1198-77-2
Formula: C5H3N4O3 • Na
16219
O=C(N1)NC2=C1C([O-])=NC(N2)=O.[Na+]
URIDINE
CAS:58-96-8
Formula: C9H12N2O6
20300
O=C(NC(C=C1)=O)N1[C@H]2[C@H](O)[C@H](O)[C@@H](CO)O2
Uridine 5'-methylenediphosphate (sodium salt)
Formula: C10H13N2O11P2 • 3Na
38691
O=C(N(C=C1)[C@H]2[C@H](O)[C@H](O)[C@@H](COP([O-])(CP([O-])([O-])=O)=O)O2)NC1=O.[Na+].[Na+].[Na+]
URIDINE-3'-MONOPHOSPHATE (SODIUM SALT)
CAS:35170-03-7
Formula: C9H11N2O9P • 2Na
16774
OC[C@@H]1[C@@H](OP([O-])([O-])=O)[C@@H](O)[C@H](N2C=CC(NC2=O)=O)O1.[Na+].[Na+]
URIDINE-5'-MONOPHOSPHATE
CAS:58-97-9
Formula: C9H13N2O9P
35382
O[C@@H]1[C@@H](COP(O)(O)=O)O[C@@]([H])(N2C(NC(C=C2)=O)=O)[C@@H]1O
URIDINE-5'-MONOPHOSPHATE (SODIUM SALT HYDRATE)
CAS:681435-27-8
Formula: C9H11N2O9P • 2Na [XH2O]
34525
O[C@@H]1[C@@H](COP([O-])([O-])=O)O[C@@]([H])(N2C(NC(C=C2)=O)=O)[C@@H]1O.[Na+].[Na+].O
Uridine-5'-O-(3-thiotriphosphate) (sodium salt)
Formula: C9H11N2O14P3S • 4Na
38692
[S-]P([O-])(OP([O-])(OP([O-])(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=CC(NC2=O)=O)=O)=O)=O.[Na+].[Na+].[Na+].[Na+]
Uridine-5'-O-triphosphoro-?-1-(5-sulfonic acid)naphthylamidate (sodium salt)
Formula: C19H19N3O17P3S • 3Na
38574
[O-]P(NC1=CC=CC2=C1C=CC=C2S(O)(=O)=O)(OP([O-])(OP([O-])(OC[C@H]3O[C@H]([C@@H]([C@@H]3O)O)N4C=CC(NC4=O)=O)=O)=O)=O.[Na+].[Na+].[Na+]
URIDINE-D2
CAS:40632-21-1
Formula: C9H10D2N2O6
36317
O[C@H]1[C@@](N2C(NC(C([2H])=C2[2H])=O)=O)([H])O[C@@H]([C@H]1O)CO
URMC-099
CAS:1229582-33-5
Formula: C27H27N5
19147
CN1CCN(CC2=CC=C(C3=CC(C(C4=CC=C(NC=C5)C5=C4)=CN6)=C6N=C3)C=C2)CC1
UROBILIN (HYDROCHLORIDE)
CAS:28925-89-5
Formula: C33H42N4O6 • HCl (for d-Urobilin IX)
36508
OC(CCC1=C(C)C(C[C@H]2NC(C(CC)=C2C)=O)=N/C1=C\C3=C(CCC(O)=O)C(C)=C(C[C@H]4NC(C(C)=C4CC)=O)N3)=O.Cl
UROCORTIN (HUMAN) (TRIFLUOROACETATE SALT)
Formula: C204H337N63O64 • XCF3COOH
24744
NC([C@H](C(C)C)NC([C@H](CO)NC([C@@H](NC([C@@H](NC([C@@]([C@H](CC)C)([H])NC([C@@]([C@H](CC)C)([H])NC([C@H](CCCNC(N)=N)NC([C@H](CC(N)=O)NC([C@H](CCC(N)=O)NC([C@H](CCC(O)=O)NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@H](CCC(O)=O)NC([C@H](CCCNC(N)=N)NC([C@H](CCC(N)=O
UROCORTIN (RAT) (TRIFLUOROACETATE SALT)
CAS:171543-83-2
Formula: C206H338N62O64 • XCF3COOH
24745
NC([C@H](C(C)C)NC([C@H](CO)NC([C@@H](NC([C@@H](NC([C@@]([C@H](CC)C)([H])NC([C@@]([C@H](CC)C)([H])NC([C@H](CCCNC(N)=N)NC([C@H](CC(N)=O)NC([C@H](CCC(N)=O)NC([C@H](CCC(O)=O)NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@H](CCC(O)=O)NC([C@H](CCCNC(N)=N)NC([C@H](CCC(N)=O
UROCORTIN II (HUMAN) (TRIFLUOROACETATE SALT)
CAS:398001-88-2
Formula: C194H339N63O54S • XCF3COOH
24746
NC([C@@H](NC([C@@H](NC(CNC([C@H](C(C)C)NC([C@H](CCCNC(N)=N)NC([C@@H](NC([C@H](CC(C)C)NC([C@@]([C@H](CC)C)([H])NC([C@H](CCCNC(N)=N)NC([C@@H](NC([C@H](CC(N)=O)NC([C@@]([C@@H](C)O)([H])NC([C@@]([C@@H](C)O)([H])NC([C@@H](NC([C@H](CCC(N)=O)NC([C@H](CCC(O)=O)NC
UROCORTIN II (MOUSE) (TRIFLUOROACETATE SALT)
Formula: C187H320N56O50 • XCF3COOH
24747
NC([C@H](C(C)C)NC([C@@H](NC([C@@H](NC([C@H](CC(C)C)NC([C@@]([C@H](CC)C)([H])NC([C@H](CCC(N)=O)NC([C@@H](NC([C@H](CC(N)=O)NC([C@@]([C@@H](C)O)([H])NC([C@@H](NC([C@@H](NC([C@H](CCC(N)=O)NC([C@H](CC(N)=O)NC([C@H](CCCNC(N)=N)NC([C@@H](NC([C@@H](NC([C@H](CCCCN
UROCORTIN III (HUMAN) (TRIFLUOROACETATE SALT)
CAS:357952-09-1
Formula: C185H307N53O50S2 • XCF3COOH
24748
NC([C@@]([C@H](CC)C)([H])NC([C@H](CCC(N)=O)NC([C@@H](NC([C@@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC([C@H](CC(N)=O)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CCC(N)=O)NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@H](CC(C)C)NC([C@H](CC(N)=O)NC([C@H](CCCCN)NC([C@@H](NC(
UROCORTIN III (MOUSE) (TRIFLUOROACETATE SALT)
Formula: C186H311N51O53S2 • XCF3COOH
24750
[H]N[C@H](C(N[C@]([C@@H](C)O)([H])C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](C(C)C)C(N1CCC[C@H]1C(N[C@]([C@@H](C)O)([H])C(N[C@@H](CC(N)=O)C(N[C@]([C@H](CC)C)([H])C(N[C@H](C(N[C@@H](CC(N)=O)C(N[C@]([C@H](CC)C)([H])C(N[C@@H](CC(C)C)C(
UROCORTIN III (MOUSE) (TRIFLUOROACETATE SALT)
Formula: C186H312N52O52S2 • XCF3COOH
24749
NC([C@@]([C@H](CC)C)([H])NC([C@H](CCC(N)=O)NC([C@@H](NC([C@@H](NC([C@H](CC(C)C)NC([C@H](CCC(N)=O)NC([C@@H](NC([C@H](CC(N)=O)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CCCCN)NC([C@@H](NC([C@H](CCCNC(N)=N)NC([C@H](CC(C)C)NC([C@H](CC(N)=O)NC([C@H](CCCCN)NC([C@@H
URODILATIN
CAS:115966-23-9
Formula: C145H234N52O44S3
17400
[H]N[C@]([C@@H](C)O)([H])C(N[C@H](C(N1CCC[C@H]1C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CO)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CO)C(N[C@@H](CO)C(N[C@H](C(N[C@H](C(NCC(NCC(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N
UROLITHIN A
CAS:1143-70-0
Formula: C13H8O4
22607
OC(C=C1)=CC2=C1C3=CC=C(O)C=C3C(O2)=O
UROLITHIN B
CAS:1139-83-9
Formula: C13H8O3
33757
O=C1OC2=C(C3=C1C=CC=C3)C=CC(O)=C2
UROTENSIN I (WHITE SUCKER) (TRIFLUOROACETATE SALT)
Formula: C210H340N62O67S2 • XCF3COOH
24752
NC([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@H](CCCCN)NC([C@H](CCCNC(N)=N)NC([C@H](CC(N)=O)NC([C@H](CC(C)C)NC(CNC([C@@H](NC([C@H](CCC(N)=O)NC([C@H](CCC(O)=O)NC([C@H](CCCNC(N)=N)NC([C@H](CCC(O)=O)NC([C@H](CC(N)=O)NC([C@H](CCC(
UROTENSIN II (GOBY) (TRIFLUOROACETATE SALT)
Formula: C62H84N14O17S2 • XCF3COOH
24753
[H]N[C@H](C(NCC(N[C@]([C@@H](C)O)([H])C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCCCN)C(N[C@H](C1=O)CC2=CC=C(O)C=C2)=O)=O)CC3=CNC4=C3C=CC=C4)=O)CC5=CC=CC=C5)=O)CSSC[C@H](N1)C(N[C@@H](C(C)C)C(O)=O)=O)=O)CC(O)=O)=O)C)=O)=O)=O)C.FC(F)(C(O)=O)F
UROTENSIN II (HUMAN) (TRIFLUOROACETATE SALT)
Formula: C64H85N13O18S2 • XCF3COOH
24711
[H]N[C@@H](CCC(O)=O)C(N[C@]([C@@H](C)O)([H])C(N1CCC[C@H]1C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCCCN)C(N[C@H](C2=O)CC3=CC=C(O)C=C3)=O)=O)CC4=CNC5=C4C=CC=C5)=O)CC6=CC=CC=C6)=O)CSSC[C@H](N2)C(N[C@@H](C(C)C)C(O)=O)=O)=O)CC(O)=O)=O)=O)=O.FC(F)(C(O)=O)
URSOCHOLIC ACID
CAS:2955-27-3
Formula: C24H40O5
29883
C[C@H](CCC(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C
URSOCHOLIC ACID-D4
Formula: C24H36D4O5
35419
C[C@H](CCC(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C
URSODEOXYCHOLIC ACID
CAS:128-13-2
Formula: C24H40O4
31016
OC(CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C)=O
URSODEOXYCHOLIC ACID (SODIUM SALT)
CAS:31687-65-7
Formula: C24H39O4 • xNa
15121
[O-]C(CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C)=O.[Na]
URSODEOXYCHOLIC ACID-D4
CAS:347841-46-7
Formula: C24H36D4O4
21892
OC(CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])CC[C@@]21C)=O
URSOLIC ACID
CAS:77-52-1
Formula: C30H48O3
10072
C[C@@H]1CC[C@]2(C(O)=O)CC[C@@]3(C)[C@]4(C)CC[C@@]5([H])C(C)(C)[C@@H](O)CC[C@]5(C)[C@@]4([H])CC=C3[C@]2([H])[C@H]1C
URUMIN (TRIFLUOROACETATE SALT)
Formula: C129H198N42O35S2• XCF3COOH
24277
[H]N[C@]([C@H](CC)C)([H])C(N1CCC[C@H]1C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(NCC(N[C@H](C(N[C@H](C(N[C@]([C@H](CC)C)([H])C(N[C@@H](CC(N)=O)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@H](C(N[C@@H](CO)C(N[C@@H](CCC(N)=O)C(N[C@H](C(N[C@H](C(N[C@@H](CCCNC(N)=N)C
Usmarapride (oxalate)
CAS:1428862-33-2
Formula: C21H29N5O2 • C2H2O4
35867
O=C(C(O)=O)O.CC(C)N(C1=C2C=CC=C1)N=C2C3=NN=C(C4CCN(CC4)CCCOC)O3
USP7-USP47 INHIBITOR
CAS:1247825-37-1
Formula: C18H11Cl2N3O3S3
25622
CS(C1=CC=C(NC(C2=CC(C#N)=C(SC3=C(Cl)C=NC=C3Cl)S2)=O)C=C1)(=O)=O
UT-11
Formula: C17H19Cl2N3O2S
38580
ClC1=C(Cl)C=C(SC(N2CCC(C(N[C@@H]3CCOC3)=O)CC2)=N4)C4=C1
UTP (sodium salt)
CAS:19817-92-6
Formula: C9H12N2O15P3 • 3Na
9.00353e+006
O=P(OP(OP(O)([O-])=O)([O-])=O)([O-])OC[C@@H]1[C@@H](O)[C@@H](O)[C@@](N2C(NC(C=C2)=O)=O)([H])O1.[Na+].[Na+].[Na+]
UVAOL
CAS:545-46-0
Formula: C30H50O2
33915
C[C@@]12C([C@@]3([H])[C@@](CC2)(CC[C@H]([C@@H]3C)C)CO)=CC[C@@]4([H])[C@]1(CC[C@]5([H])[C@@]4(CC[C@@H](C5(C)C)O)C)C
UVI3003
CAS:847239-17-2
Formula: C28H36O4
16026
OC1=C(C2=C(OCCCCC)C=C(C(C)(C)CCC3(C)C)C3=C2)C=C(/C=C/C(O)=O)C=C1
V-0219 (hydrochloride)
CAS:2922283-73-4
Formula: C20H25F3N4O2 • HCl
39740
FC(F)(F)C(C=C1)=CC=C1C2=NOC(CN(CCC3)CC3CN4CCOCC4)=N2.Cl
V-125
CAS:1807740-94-8
Formula: C23H30N2O2
37532
CC1(C)C2=C(C=C(C)C(N(CC)C3=CC=C(C(O)=O)C=N3)=C2)C(C)(C)CC1
V-9302
CAS:1855871-76-9
Formula: C34H38N2O4
27688
CC1=CC=CC(COC2=C(CN(CC3=C(OCC4=CC(C)=CC=C4)C=CC=C3)CC[C@H](N)C(O)=O)C=CC=C2)=C1
VABORBACTAM
CAS:1360457-46-0
Formula: C12H16BNO5S
23962
OB1O[C@H](CC(O)=O)CC[C@@H]1NC(CC2=CC=CS2)=O
VACUOLIN-1
CAS:351986-85-1
Formula: C26H24IN7O
20425
IC1=CC(/C=N/NC2=NC(N(C3=CC=CC=C3)C4=CC=CC=C4)=NC(N5CCOCC5)=N2)=CC=C1
VADADUSTAT
CAS:1000025-07-9
Formula: C14H11ClN2O4
15295
ClC1=CC=CC(C2=CC(O)=C(C(NCC(O)=O)=O)N=C2)=C1
VAF347
CAS:574759-62-9
Formula: C17H11ClF3N3
37328
FC(F)(C1=CC=C(NC2=NC=CC(C3=CC(Cl)=CC=C3)=N2)C=C1)F
Val-Cit-PAB-MMAE
CAS:644981-35-1
Formula: C58H94N10O12
41048
C[C@@H](C(N[C@H](C)[C@H](C1=CC=CC=C1)O)=O)[C@H]([C@@](CCC2)([H])N2C(C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C([C@H](C(C)C)NC([C@H](C(C)C)N(C)C(OCC(C=C3)=CC=C3NC([C@H](CCCNC(N)=O)NC([C@@H](N)C(C)C)=O)=O)=O)=O)=O)=O)OC
VAL-CIT-PAB-OH
CAS:159857-79-1
Formula: C18H29N5O4
34818
CC(C)[C@H](N)C(N[C@@H](CCCNC(N)=O)C(NC1=CC=C(C=C1)CO)=O)=O
VALDECOXIB
CAS:181695-72-7
Formula: C16H14N2O3S
1.00061e+007
CC1=C(C2=CC=C(S(N)(=O)=O)C=C2)C(C3=CC=CC=C3)=NO1
VALDECOXIB-D3
CAS:1219794-90-7
Formula: C16H11D3N2O3S
28699
[2H]C([2H])([2H])C1=C(C2=CC=C(S(N)(=O)=O)C=C2)C(C3=CC=CC=C3)=NO1
VALEMETOSTAT
CAS:1809336-39-7
Formula: C26H34ClN3O4
31674
CC1=C2C(O[C@@](O2)([C@]3([H])CC[C@H](CC3)N(C)C)C)=C(C=C1C(NCC4=C(C=C(NC4=O)C)C)=O)Cl
VALERENIC ACID
CAS:3569-10-6
Formula: C15H22O2
40113
[H][C@@]12[C@H](C)CC[C@@H](/C=C(C(O)=O)\C)C1=C(CC2)C
VALEROYL SALICYLATE
CAS:64206-54-8
Formula: C12H14O4
70670
CCCCC(=O)Oc1ccccc1C(=O)O
VALERYL FENTANYL CARBOXY METABOLITE
CAS:526191-19-5
Formula: C24H30N2O3
20497
O=C(N(C1=CC=CC=C1)C2CCN(CCC3=CC=CC=C3)CC2)CCCC(O)=O
VALERYL-L-CARNITINE (CHLORIDE)
CAS:162040-64-4
Formula: C12H24NO4 • Cl
26563
OC(C[C@H](C[N+](C)(C)C)OC(CCCC)=O)=O.[Cl-]
VALERYL-L-CARNITINE-D3 (CHLORIDE)
Formula: C12H21D3NO4 • Cl
27871
OC(C[C@H](C[N+](C)(C)C)OC(CCCC([2H])([2H])[2H])=O)=O.[Cl-]
VALGANCICLOVIR (HYDROCHLORIDE)
CAS:175865-59-5
Formula: C14H22N6O5 • HCl
13875
CC(C)[C@H](N)C(OCC(CO)OCN1C(NC(N)=NC2=O)=C2N=C1)=O.Cl
VALGANCICLOVIR-D5 (HYDROCHLORIDE)
Formula: C14H17D5N6O5 • HCl
30746
CC(C)C(N)C(OC([2H])([2H])C(C([2H])([2H])O)([2H])OCN1C(NC(N)=NC2=O)=C2N=C1)=O.Cl
VALIDAMYCIN A
CAS:37248-47-8
Formula: C20H35NO13
15326
O[C@H]([C@H]1O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]2[C@H](O)[C@@H](O)[C@@H](N[C@@]3([H])C=C(CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]2CO
VALILACTONE
CAS:113276-96-3
Formula: C22H39NO5
13690
CCCCC[C@H](OC([C@@H](NC([H])=O)C(C)C)=O)C[C@H]1[C@H](CCCCCC)C(O1)=O
VALNEMULIN
CAS:101312-92-9
Formula: C31H52N2O5S
20141
O=C1CC[C@@]2(CC[C@H]3C)[C@@H](C)[C@H](O)[C@@](C=C)(C)C[C@@H](OC(CSC(C)(C)CNC([C@H](N)C(C)C)=O)=O)[C@@]3(C)[C@@]21[H]
VALNOCTAMIDE
CAS:4171-13-5
Formula: C8H17NO
18456
CCC(C(N)=O)C(C)CC
VALPROIC ACID
CAS:99-66-1
Formula: C8H16O2
35739
CCCC(CCC)C(O)=O
VALPROIC ACID (SODIUM SALT)
CAS:1069-66-5
Formula: C8H15O2 • Na
13033
CCCC(CCC)C([O-])=O.[Na+]
Valproic Acid ß-D-Glucuronide
CAS:60113-83-9
Formula: C14H24O8
22459
CCCC(CCC)C(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O1)=O
VALPROIC ACID-D4
CAS:87745-17-3
Formula: C8H12D4O2
39966
CCC([2H])([2H])C(C([2H])([2H])CC)C(O)=O
VALROCEMIDE
CAS:92262-58-3
Formula: C10H20N2O2
30909
CCCC(CCC)C(NCC(N)=O)=O
VALSARTAN
CAS:137862-53-4
Formula: C24H29N5O3
14178
O=C(CCCC)N([C@@](C(O)=O)([H])C(C)C)CC1=CC=C(C2=CC=CC=C2C3=NNN=N3)C=C1
VALSARTAN ACID
CAS:164265-78-5
Formula: C14H10N4O2
35361
O=C(C1=CC=C(C2=C(C3=NN=NN3)C=CC=C2)C=C1)O
VALSARTAN-D9
CAS:1089736-73-1
Formula: C24H20D9N5O3
25226
O=C(C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])N([C@@](C(O)=O)([H])C(C)C)CC1=CC=C(C2=CC=CC=C2C3=NNN=N3)C=C1
VANCOMYCIN (HYDROCHLORIDE)
CAS:1404-93-9
Formula: C66H75Cl2N9O24 • XHCl
15327
O[C@@H]1[C@@H](O[C@@](O[C@@H](C)[C@H]2O)([H])C[C@@]2(N)C)[C@@H](O[C@H](CO)[C@H]1O)OC3=C(OC4=CC=C([C@H]([C@H]5NC([C@H](NC)CC(C)C)=O)O)C=C4Cl)C=C([C@](NC([C@@H](NC5=O)CC(N)=O)=O)([H])C(N[C@](C6=O)([H])C7=CC8=C(O)C=C7)=O)C=C3OC9=CC=C([C@H]([C@](C(N[C@@](C(O)
VANDETANIB
CAS:443913-73-3
Formula: C22H24BrFN4O2
14706
COC1=C(OCC2CCN(C)CC2)C=C3C(C(NC4=CC=C(Br)C=C4F)=NC=N3)=C1
VANDETANIB-D6
CAS:1174683-49-8
Formula: C22H18BrD6FN4O2
28710
FC1=CC(Br)=CC=C1NC2=NC=NC3=CC(OCC4CCN(C([2H])([2H])[2H])CC4)=C(OC([2H])([2H])[2H])C=C32
VANILLIC ACID
CAS:121-34-6
Formula: C8H8O4
39643
O=C(C1=CC=C(C(OC)=C1)O)O
Vanillic Acid 4-ß-D-glucopyranoside
CAS:32142-31-7
Formula: C14H18O9
19759
OC(C(C=C1)=CC(OC)=C1O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=O
VANILLIN
CAS:121-33-5
Formula: C8H8O3
36422
O=CC1=CC=C(C(OC)=C1)O
Vanillin 4-O-ß-D-Glucoside
CAS:494-08-6
Formula: C14H18O8
35908
COC(C=C(C=C1)C=O)=C1O[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)CO
VANOXONIN
CAS:86933-99-5
Formula: C18H25N3O9
32931
CC(N(O)CCC[C@@H](C(O)=O)NC([C@H]([C@H](O)C)NC(C1=C(C(O)=CC=C1)O)=O)=O)=O
VAPENDAVIR
CAS:439085-51-5
Formula: C21H26N4O3
30546
CCOC1=NOC2=CC(OCCC3CCN(C4=CC=C(C)N=N4)CC3)=CC=C21
VAPENDAVIR-D5
CAS:2738376-73-1
Formula: C21H21D5N4O3
31320
CC1=CC=C(N=N1)N(CC2)CCC2CCOC3=CC=C(C(OC([2H])([2H])C([2H])([2H])[2H])=NO4)C4=C3
VAPREOTIDE (TRIFLUOROACETATE SALT)
Formula: C57H70N12O9S2 • XCF3COOH
24558
O=C(N[C@@H](C(C)C)C(N[C@H](C(N[C@@H](CC1=CNC2=C1C=CC=C2)C(N)=O)=O)CSSC[C@H](NC([C@H](N)CC3=CC=CC=C3)=O)C4=O)=O)[C@H](CCCCN)NC([C@@H](CC5=CNC6=C5C=CC=C6)NC([C@@](CC7=CC=C(O)C=C7)([H])N4)=O)=O.FC(F)(C(O)=O)F
VARENICLINE (TARTRATE)
CAS:375815-87-5
Formula: C13H13N3 • C4H6O6
15030
O[C@H]([C@@H](O)C(O)=O)C(O)=O.C12=CC3=C(N=CC=N3)C=C1C4CNCC2C4
VARENICLINE-D4
CAS:2183239-01-0
Formula: C13H9D4N3
26102
[2H]C1([2H])NC([2H])([2H])C2C3=CC4=C(N=CC=N4)C=C3C1C2
VARICULANOL
CAS:135513-21-2
Formula: C25H40O2
29064
O[C@H](C1)[C@H](C(C)C)[C@@]2([H])[C@@]1(C)[C@H](O)/C=C(C)/CC[C@](C(CC3)=C)([H])[C@]3([H])/C(C)=C/C2
VARINOLIC ACID
CAS:4707-50-0
Formula: C10H12O4
26283
OC1=CC(O)=C(C(O)=O)C(CCC)=C1
VARIOXEPINE A
CAS:1623451-72-8
Formula: C26H29N3O5
32934
CC(C)C(NC1=O)=C2N=C(OC=CC=C3)[C@@]3(OC[C@H](C(C)(O4)C)O5)[C@]54N2[C@H]1CC6=CC=CC=C6
VARLITINIB
CAS:845272-21-1
Formula: C22H19ClN6O2S
27651
ClC1=C(OCC2=NC=CS2)C=CC(NC3=NC=NC4=C3C=C(NC5=N[C@H](C)CO5)C=C4)=C1
VAS2870
CAS:722456-31-7
Formula: C18H12N6OS
19205
C12=C(SC3=NC4=C(C=CC=C4)O3)N=CN=C1N(CC5=CC=CC=C5)N=N2
VASICINONE
CAS:486-64-6
Formula: C11H10N2O2
11761
O[C@H]1CCN2C1=NC(C=CC=C3)=C3C2=O
VATALANIB (HYDROCHLORIDE)
CAS:212141-51-0
Formula: C20H15ClN4 • 2HCl
14868
ClC(C=C1)=CC=C1NC2=NN=C(CC3=CC=NC=C3)C4=CC=CC=C42.Cl.Cl
VBIT-12
CAS:2089227-65-4
Formula: C25H27N3O3
31445
O=C(CNC(C1(CCN(CC1)CC2=CC=CC3=C2C=CC=C3)NC4=CC=CC=C4)=O)O
VCP171
CAS:1018830-99-3
Formula: C18H12F3NOS
30309
NC1=C(C(C2=CC=CC=C2)=O)C(C3=CC(C(F)(F)F)=CC=C3)=CS1
VE-821
CAS:1232410-49-9
Formula: C18H16N4O3S
17587
O=C(C1=NC(C2=CC=C(S(C)(=O)=O)C=C2)=CN=C1N)NC3=CC=CC=C3
VECURONIUM (BROMIDE)
CAS:50700-72-6
Formula: C34H57N2O4 • Br
15603
C[C@@]12[C@](C[C@H]([N+]3(C)CCCCC3)[C@@H]2OC(C)=O)([H])[C@]4([H])CC[C@@]5([H])C[C@H](OC(C)=O)[C@@H](N6CCCCC6)C[C@]5(C)[C@@]4([H])CC1.[Br-]
VEDAPROFEN
CAS:71109-09-6
Formula: C19H22O2
15960
CC(C(O)=O)C(C1=C2C=CC=C1)=CC=C2C3CCCCC3
VEGFR TYROSINE KINASE INHIBITOR II
CAS:269390-69-4
Formula: C19H16ClN3O
17654
ClC1=CC=C(NC(C2=CC=CC=C2NCC3=CC=NC=C3)=O)C=C1
VEGFR2 KINASE INHIBITOR I
CAS:15966-93-5
Formula: C18H18N2O3
13578
O=C(N1)/C(C2=C1C=CC=C2)=C\C3=C(C)C(C(OCC)=O)=C(C)N3
VEGFR2 KINASE INHIBITOR II
CAS:288144-20-7
Formula: C17H15BrN2O
17544
O=C(NC1=C/2C=C(Br)C=C1)C2=C/C(N3)=CC4=C3CCCC4
VELARESOL
CAS:77858-21-0
Formula: C12H14O5
37190
O=CC1=C(OCCCCC(O)=O)C=CC=C1O
VELNEPERIT
CAS:342577-38-2
Formula: C17H24F3N3O3S
33850
FC(F)(F)C(C=N1)=CC=C1NC([C@H]2CC[C@@H](CC2)NS(C(C)(C)C)(=O)=O)=O
VELPATASVIR
CAS:1377049-84-7
Formula: C49H54N8O8
21280
O=C([C@H](C(C)C)NC(OC)=O)N([C@@H](C)CC1)[C@@H]1C(N2)=NC3=C2C4=CC(OC5)=C(C=C4C=C3)C6=C5C=C(C7=CN=C([C@@H]8C[C@H](COC)CN8C([C@H](NC(OC)=O)C9=CC=CC=C9)=O)N7)C=C6
VENTURICIDIN A
CAS:33538-71-5
Formula: C41H67NO11
15377
CC1=CC[C@](CC(O[C@]([H])([C@@H](C[C@H]([C@@H]([C@@H](C(CC)=O)C)O)C)C)[C@@H]2C)=O)(O[C@@]1(/C(C)=C\CCC[C@@]([H])(O[C@@]([H])(C[C@H]3OC(N)=O)O[C@@H]([C@H]3O)C)/C=C/[C@@H](C2)C)[H])O
VENTURICIDIN B
CAS:33538-72-6
Formula: C40H66O10
25478
CC1=CC[C@](CC(O[C@]([H])([C@@H](C[C@H]([C@@H]([C@@H](C(CC)=O)C)O)C)C)[C@@H]2C)=O)(O[C@@]1(/C(C)=C\CCC[C@@]([H])(O[C@@]([H])(C[C@H]3O)O[C@@H]([C@H]3O)C)/C=C/[C@@H](C2)C)[H])O
VER-155008
CAS:1134156-31-2
Formula: C25H23Cl2N7O4
17257
O[C@H]1[C@@H](O)[C@H](N2C(NCC3=CC=C(Cl)C(Cl)=C3)=NC4=C2N=CN=C4N)O[C@@H]1COCC5=CC=C(C#N)C=C5
VER-246608
CAS:1684386-71-7
Formula: C28H23ClF2N4O4
19182
OC1=CC(O)=C(C(N(C2=CC=C(C3=NC(Cl)=NC=C3C)C=C2)CC4=CC=C(CNC(C(F)F)=O)C=C4)=O)C=C1
VER-49009
CAS:558640-51-0
Formula: C19H18ClN3O4
13131
ClC1=C(O)C=C(O)C(C2=NNC(C(NCC)=O)=C2C3=CC=C(OC)C=C3)=C1
VER-50589
CAS:747413-08-7
Formula: C19H17ClN2O5
13132
CCNC(=O)c1noc(c1c1ccc(OC)cc1)c1cc(Cl)c(O)cc1O
VERATROSINE
CAS:475-00-3
Formula: C33H49NO7
34617
C[C@@]12[C@]3([H])[C@](CC=C1C[C@H](CC2)O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO)([H])C5=CC=C([C@@H]([C@@]6([H])[C@@H](C[C@@H](CN6)C)O)C)C(C)=C5C3
VERBASCOSIDE
CAS:61276-17-3
Formula: C29H36O15
24965
OC1=CC=C(/C=C/C(O[C@H]2[C@H](O[C@]3([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](OCCC4=CC=C(O)C(O)=C4)O[C@@H]2CO)=O)C=C1O
VERBENALIN
CAS:548-37-8
Formula: C17H24O10
34663
COC(C1=CO[C@H]([C@@]2([H])[C@]1([H])C(C[C@@H]2C)=O)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)=O
VERCIRNON
CAS:698394-73-9
Formula: C22H21ClN2O4S
23131
O=C(C(C=C1)=CC=[N]1=O)C(C=C(Cl)C=C2)=C2N[S](=O)(C3=CC=C(C(C)(C)C)C=C3)=O
VERDINEXOR
CAS:1392136-43-4
Formula: C18H12F6N6O
26171
O=C(NNC1=CC=CC=N1)/C=C\N2C=NC(C3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)=N2
VERDIPERSTAT
CAS:890655-80-8
Formula: C11H15N3O2S
37333
O=C1NC(N(CCOC(C)C)C2=C1NC=C2)=S
VERICIGUAT
CAS:1350653-20-1
Formula: C19H16F2N8O2
35253
O=C(NC1=C(N)N=C(C2=NN(CC3=C(F)C=CC=C3)C4=C2C=C(F)C=N4)N=C1N)OC
VERINURAD
CAS:1352792-74-5
Formula: C20H16N2O2S
29667
OC(C(C)(C)SC1=CC=NC=C1C2=CC=C(C#N)C3=C2C=CC=C3)=O
Verrucarin H
CAS:29953-50-2
Formula: C29H36O8
40936
CC(CC1OC(C)C(O1)C=CC=CC(OC2C3)=O)=CC(OCC45C2(C)C6(OC6)C3OC4C=C(C)CC5)=O
VERRUCARIN J
CAS:4643-58-7
Formula: C27H32O8
40815
C/C(CCOC(/C=C/C=C\C(O[C@@H]1C2)=O)=O)=C\C(OC[C@@]34[C@]1(C)[C@@]5(OC5)[C@@H]2O[C@]3([H])C=C(C)CC4)=O
VERRUCOFORTINE
CAS:113706-21-1
Formula: C24H31N3O3
28062
CC([C@]12C3=CC=CC=C3N(C(C)=O)[C@]1(N([C@](C2)([H])C(N4)=O)C([C@@H]4CC(C)C)=O)[H])(C=C)C
VERTEPORFIN
CAS:129497-78-5
Formula: C41H42N4O8
17334
CC1=C(CCC(O)=O)/C([N]=C1/C=C(C(C=C)=C/2C)\[NH]C2=C/3)=C/C4=C(CCC(OC)=O)C(C)=C(/C=C5[N]=C3C6=CC=C(C(OC)=O)[C@@H](C(OC)=O)[C@@]\56C)[NH]4
VERUBECESTAT
CAS:1286770-55-5
Formula: C17H17F2N5O3S
21115
FC1=CN=C(C(NC2=CC([C@]3(C)CS(N(C)C(N)=N3)(=O)=O)=C(F)C=C2)=O)C=C1
VESNARINONE
CAS:81840-15-5
Formula: C22H25N3O4
23489
COC1=CC=C(C(N2CCN(C3=CC(CCC(N4)=O)=C4C=C3)CC2)=O)C=C1OC
VH 032 Linker 1
CAS:2097971-11-2
Formula: C30H45N5O7S • HCl
26148
O=C([C@@H](NC(COCCOCCOCCN)=O)C(C)(C)C)N1C[C@H](O)C[C@H]1C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O.Cl
VH 032 LINKER 2
CAS:2064292-52-8
Formula: C32H49N5O8S • HCl
26149
O=C([C@@H](NC(COCCOCCOCCOCCN)=O)C(C)(C)C)N1C[C@H](O)C[C@H]1C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O.Cl
VH 032 LINKER 3 (HYDRATE)
Formula: C27H39N5O4S • 2HCl [XH2O]
26151
O=C([C@@H](NC(CCCCN)=O)C(C)(C)C)N1C[C@H](O)C[C@H]1C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O.Cl.Cl.O
VH 032 Linker 6
CAS:2098799-80-3
Formula: C31H42N4O7S
38898
O=C([C@@H](NC(COCCOCCOCC#C)=O)C(C)(C)C)N1C[C@H](O)C[C@H]1C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O
VH 298
CAS:2097381-85-4
Formula: C27H33N5O4S
21133
O[C@H]1CN(C([C@@H](NC(C2(C#N)CC2)=O)C(C)(C)C)=O)[C@H](C(NCC3=CC=C(C4=C(C)N=CS4)C=C3)=O)C1
VHL LIGAND 1 (HYDROCHLORIDE)
CAS:1448189-80-7
Formula: C22H30N4O3S • HCl
21591
N[C@H](C(N1C[C@H](O)C[C@H]1C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O)=O)C(C)(C)C.Cl
VIALININ A
CAS:858134-23-3
Formula: C34H26O8
1.00105e+007
Oc1ccc(cc1)c1c(OC(=O)Cc2ccccc2)c(OC(=O)Cc2ccccc2)c(c2ccc(O)cc2)c(O)c1O
VIAMINATE
CAS:53839-71-7
Formula: C29H37NO3
40118
CC(/C=C/C1=C(C)CCCC1(C)C)=C\C=C\C(C)=C\C(NC2=CC=C(C(OCC)=O)C=C2)=O
VICENIN-2
CAS:23666-13-9
Formula: C27H30O15
33403
OC[C@H]([C@H]([C@@H]([C@H]1O)O)O)O[C@H]1C2=C3OC(C4=CC=C(O)C=C4)=CC(C3=C(O)C([C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)=C2O)=O
VICRIVIROC (MALEATE)
CAS:599179-03-0
Formula: C28H38F3N5O2 • C4H4O4
28453
FC(F)(F)C1=CC=C([C@@H](N2CCN(C3(C)CCN(C(C4=C(C)N=CN=C4C)=O)CC3)C[C@@H]2C)COC)C=C1.OC(/C=C\C(O)=O)=O
VIDARABINE
CAS:5536-17-4
Formula: C10H13N5O4
18149
OC[C@@H]1[C@@H](O)[C@H](O)[C@H](N2C=NC3=C2N=CN=C3N)O1
VIDOFLUDIMUS
CAS:717824-30-1
Formula: C20H18FNO4
18377
COC1=CC(C2=CC(F)=C(NC(C3=C(C(O)=O)CCC3)=O)C=C2)=CC=C1
viFSP1
CAS:951945-67-8
Formula: C16H17N3O3S
39927
COC1=CC=C(N2C(N)=C(C3=NC(C)=CS3)C(C2)=O)C(OC)=C1
VIGABATRIN
CAS:68506-86-5
Formula: C6H11NO2
9.00098e+006
C=CC(CCC(O)=O)N
VIGABATRIN-13C-D2 (HYDROCHLORIDE)
CAS:2749628-08-6
Formula: C5[13C]H9D2NO2 • HCl
26672
NC(CCC(O)=O)/C=[13C]([2H])/[2H].Cl
Vilanterol (triphenylacetate)
CAS:503070-58-4
Formula: C24H33Cl2NO5 • C20H16O2
39536
ClC1=C(COCCOCCCCCCNC[C@H](O)C2=CC(CO)=C(O)C=C2)C(Cl)=CC=C1.O=C(O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
VILANTEROL-D4 (TRIPHENYLACETATE)
CAS:2021249-10-3
Formula: C24H29Cl2D4NO5 • C20H16O2
30813
ClC1=C(COC([2H])([2H])C([2H])([2H])OCCCCCCNC[C@H](O)C2=CC(CO)=C(O)C=C2)C(Cl)=CC=C1.O=C(O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
VILAZODONE (HYDROCHLORIDE)
CAS:163521-08-2
Formula: C26H27N5O2 • HCl
21547
O=C(N)C(O1)=CC2=C1C=CC(N3CCN(CCCCC4=CNC5=C4C=C(C#N)C=C5)CC3)=C2.Cl
VILAZODONE-D8
CAS:1794789-93-7
Formula: C26H19D8N5O2
25712
O=C(N)C(O1)=CC2=C1C=CC(N3C([2H])([2H])C([2H])([2H])N(CCCCC4=CNC5=C4C=C(C#N)C=C5)C([2H])([2H])C3([2H])[2H])=C2
VILDAGLIPTIN
CAS:274901-16-5
Formula: C17H25N3O2
14705
O=C(CN[C@@]1(CC(C2)C3)CC3C[C@]2(O)C1)N4[C@H](C#N)CCC4
VILDAGLIPTIN CARBOXYLIC ACID METABOLITE (TRIFLUOROACETATE SALT)
CAS:565453-41-0
Formula: C17H26N2O4 • CF3COOH
22088
O=C(CN[C@@]1(CC(C2)C3)CC3C[C@]2(O)C1)N4[C@H](C(O)=O)CCC4.OC(C(F)(F)F)=O
VILDAGLIPTIN-D7
CAS:1133208-42-0
Formula: C17H18D7N3O2
22373
O=C(CN[C@@]1(CC(C2)C3)CC3C[C@]2(O)C1)N4[C@]([2H])(C#N)C([2H])([2H])C([2H])([2H])C4([2H])[2H]
Viloxazine (hydrochloride)
CAS:35604-67-2
Formula: C13H19NO3 • HCl
39679
CCOC1=CC=CC=C1OCC2CNCCO2.Cl
Vimseltinib
CAS:1628606-05-2
Formula: C23H25N7O2
38783
CN1C=C(C2=CC(OC3=CC=C(C4=CN=C(NC(C)C)N(C4=O)C)N=C3C)=CC=N2)C=N1
VINBLASTINE (SULFATE)
CAS:143-67-9
Formula: C46H58N4O9 • H2SO4
11762
CC[C@]1(O)C[C@@](C[N@@](CC2)C1)([H])C[C@](C(OC)=O)(C3=C(OC)C=C(N(C)[C@]4([H])[C@@]56[C@](N7CC6)([H])[C@](C=CC7)(CC)[C@@H](OC(C)=O)[C@]4(O)C(OC)=O)C5=C3)C8=C2C(C=CC=C9)=C9N8.O=S(O)(O)=O
VINCAMINE
CAS:1617-90-9
Formula: C21H26N2O3
11763
CC[C@]1(CCC2)C[C@@](C(OC)=O)(O)N3C4=CC=CC=C4C5=C3[C@@]1([H])N2CC5
VINCLOZOLIN
CAS:50471-44-8
Formula: C12H9Cl2NO3
23939
ClC1=CC(N2C(OC(C)(C=C)C2=O)=O)=CC(Cl)=C1
VINCLOZOLIN M2
CAS:83792-61-4
Formula: C11H11Cl2NO2
1.00075e+007
C=CC(C)(O)C(=O)Nc1cc(Cl)cc(Cl)c1
VINDOLINE
CAS:2182-14-1
Formula: C25H32N2O6
11765
COC1=CC=C2C(N(C)[C@]3([H])[C@@]24[C@]5([H])[C@](C=CCN5CC4)(CC)[C@@H](OC(C)=O)[C@@]3(C(OC)=O)O)=C1
VINPOCETINE
CAS:42971-09-5
Formula: C22H26N2O2
19578
O=C(OCC)C(N1C2=C3C=CC=C2)=C[C@]4(CC)CCCN5[C@]4([H])C1=C3CC5
VINYL-L-NIO (HYDROCHLORIDE)
CAS:728944-69-2
Formula: C9H17N3O2 • HCl
80330
C=CCC(NCCC[C@H](N)C(O)=O)=N.Cl
VIOLACEIN
CAS:548-54-9
Formula: C20H13N3O3
27959
O=C(N1)/C(C2=C1C=CC=C2)=C3C(NC(C4=CNC5=C4C=C(O)C=C5)=C/3)=O
VIP (HUMAN, PORCINE, RAT, OVINE) (TRIFLUOROACETATE SALT)
Formula: C147H238N44O42S • XCF3COOH
24996
NC([C@H](CC(N)=O)NC([C@H](CC(C)C)NC([C@@]([C@H](CC)C)([H])NC([C@H](CO)NC([C@H](CC(N)=O)NC([C@H](CC(C)C)NC([C@@H](NC([C@H](CCCCN)NC([C@H](CCCCN)NC([C@H](C(C)C)NC([C@@H](NC([C@@H](NC([C@H](CCC(N)=O)NC([C@H](CCCCN)NC([C@H](CCCNC(N)=N)NC([C@H](CC(C)C)NC([C@H]
VIPADENANT
CAS:442908-10-3
Formula: C16H15N7O
20239
NC1=NC(C2=CC=CO2)=C3C(N(CC4=CC=C(N)C(C)=C4)N=N3)=N1
Vipoglanstat
CAS:1360622-01-0
Formula: C30H34Cl2F5N5O3
37925
ClC1=CC=C(C(Cl)=C1NC2=NC3=CC(C(N[C@H]4CC[C@H](C(F)(F)F)CC4)=O)=C(OCC(F)F)C=C3N2C)CNC(C(C)(C)C)=O
VIRGINIAMYCIN COMPLEX
CAS:11006-76-1
Formula: C43H49N7O10 • C28H35N3O7
14503
O=C1CCN(C([C@@H](N(C)C([C@@]23[H])=O)CC4=CC=CC=C4)=O)[C@@](C(N[C@@H](C5=CC=CC=C5)C(O[C@H](C)[C@H](NC(C6=NC=CC=C6O)=O)C(N[C@H](CC)C(N2CCC3)=O)=O)=O)=O)([H])C1.O=C(/C=C/[C@@H](C)[C@@H](C(C)C)OC(C7=CCCN7C(C8=COC(C9)=N8)=O)=O)NC/C=C\C(C)=C\[C@@H](O)CC9=O
VIRGINIAMYCIN M1
CAS:21411-53-0
Formula: C28H35N3O7
9.00217e+006
O=C(/C=C/[C@@H](C)[C@@H](C(C)C)OC(C1=CCCN1C(C2=COC(C3)=N2)=O)=O)NC/C=C\C(C)=C\[C@@H](O)CC3=O
VIRGINIAMYCIN S1
CAS:23152-29-6
Formula: C43H49N7O10
17455
O=C1C[C@](C(N[C@@H](C2=CC=CC=C2)C(O[C@H](C)[C@H](NC(C3=C(O)C=CC=N3)=O)C4=O)=O)=O)([H])N(C([C@@](CC5=CC=CC=C5)([H])N(C)C([C@]6([H])CCCN6C([C@H](N4)CC)=O)=O)=O)CC1
VIRIDICATIN
CAS:129-24-8
Formula: C15H11NO2
21763
[H]N(C1=CC=CC=C1C(C2=CC=CC=C2)=C3O)C3=O
VIRIDICATOL
CAS:14484-44-7
Formula: C15H11NO3
25206
O=C1C(O)=C(C2=CC(O)=CC=C2)C3=CC=CC=C3N1
VIRIDIOL
CAS:23820-80-6
Formula: C20H18O6
19607
O=C1CCC2=C1C=CC([C@]3(C)C4=C5OC=C4[C@@H](O)[C@@H](OC)[C@H]3O)=C2C5=O
VIRSTATIN
CAS:88909-96-0
Formula: C16H13NO4
21176
O=C(C1=CC=CC2=CC=CC3=C12)N(CCCC(O)=O)C3=O
VIRUSTOMYCIN A
CAS:84777-85-5
Formula: C48H71NO14
27736
O=C1O[C@H]([C@@H](C)[C@@H](O)[C@H](C)[C@@]2(O)C[C@@H](OC(/C=C/C(NC3=C(O)CCC3=O)=O)=O)[C@H](C)[C@@H](/C=C\C)O2)[C@@H](OC)/C=C/C=C(C)/C[C@@H](C)[C@H](O)[C@H](CC)[C@H](O)[C@H](C)/C=C(C)\C=C1\OC
VISNAGIN
CAS:82-57-5
Formula: C13H10O4
34140
O=C1C=C(C)OC2=C1C(OC)=C3C=COC3=C2
VITAMIN A
CAS:68-26-8
Formula: C20H30O
20241
CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1
VITAMIN B12 (HYDRATE)
CAS:194937-59-2
Formula: C63H88CoN14O14P • XH2O
18425
C[C@@]12[N]([Co+3]34([N-]5[C@]2([H])[C@H](CC(N)=O)[C@@](C)(CCC(NC[C@@H](C)O[P]6([O-])=O)=O)C5=C(C)C([C@@H](CCC(N)=O)C7(C)C)=[N]3C7=CC8=[N]4C([C@](CC(N)=O)(C)[C@@H]8CCC(N)=O)=C9C)([N]%10=CN([C@]%11([H])[C@H](O)[C@H](O6)[C@@H](CO)O%11)C%12=CC(C)=C(C)C=C%10%
VITAMIN K1
CAS:84-80-0
Formula: C31H46O2
21051
O=C1C(C/C=C(C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)=C(C)C(C2=CC=CC=C21)=O
VITAMIN K1-D7
CAS:1233937-39-7
Formula: C31H39D7O2
29992
O=C1C(C/C=C(C)/CCCC(C)CCCC(C)CCCC(C)C)=C(C([2H])([2H])[2H])C(C2=C([2H])C([2H])=C([2H])C([2H])=C21)=O
VITAMIN K3
CAS:58-27-5
Formula: C11H8O2
15950
O=C1C(C)=CC(C2=CC=CC=C21)=O