Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H19N3O5S |
Molecular Weight | 365.404 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=C(O)C=C3)C(O)=O
InChI
InChIKey=LSQZJLSUYDQPKJ-NJBDSQKTSA-N
InChI=1S/C16H19N3O5S/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)/t9-,10-,11+,14-/m1/s1
Molecular Formula | C16H19N3O5S |
Molecular Weight | 365.404 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:34:27 UTC 2023
by
admin
on
Fri Dec 15 15:34:27 UTC 2023
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Record UNII |
9EM05410Q9
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Record Status |
Validated (UNII)
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Record Version |
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-
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NDF-RT |
N0000175497
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admin on Fri Dec 15 15:34:27 UTC 2023 , Edited by admin on Fri Dec 15 15:34:27 UTC 2023
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NCI_THESAURUS |
C1500
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admin on Fri Dec 15 15:34:27 UTC 2023 , Edited by admin on Fri Dec 15 15:34:27 UTC 2023
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WHO-ATC |
J01CA04
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DB01060
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26787-78-0
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277174
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DTXSID3037044
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CHEMBL1082
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9EM05410Q9
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9EM05410Q9
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2676
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3230
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3204
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SUB05481MIG
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C87367
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33613
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m1844
Created by
admin on Fri Dec 15 15:34:27 UTC 2023 , Edited by admin on Fri Dec 15 15:34:27 UTC 2023
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PRIMARY | Merck Index | ||
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1297882
Created by
admin on Fri Dec 15 15:34:27 UTC 2023 , Edited by admin on Fri Dec 15 15:34:27 UTC 2023
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PRIMARY | RxNorm | ||
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100000091596
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248-003-8
Created by
admin on Fri Dec 15 15:34:27 UTC 2023 , Edited by admin on Fri Dec 15 15:34:27 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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SALT/SOLVATE -> PARENT | |||
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BINDER->LIGAND |
BINDING
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EXCRETED UNCHANGED |
URINE
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SOLVATE->ANHYDROUS | |||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT |
Related Record | Type | Details | ||
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PRODRUG -> METABOLITE ACTIVE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Cmax | PHARMACOKINETIC |
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ROUTE OF ADMINISTRATION PHARMACOKINETIC PHARMACOKINETIC |