Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H22N3O4S.K |
Molecular Weight | 427.559 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[K+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2N3C(=O)[C@H](NC3(C)C)C4=CC=CC=C4)C([O-])=O
InChI
InChIKey=QRSPJBLLJXVPDD-XFAPPKAWSA-M
InChI=1S/C19H23N3O4S.K/c1-18(2)13(17(25)26)21-15(24)12(16(21)27-18)22-14(23)11(20-19(22,3)4)10-8-6-5-7-9-10;/h5-9,11-13,16,20H,1-4H3,(H,25,26);/q;+1/p-1/t11-,12-,13+,16-;/m1./s1
Molecular Formula | K |
Molecular Weight | 39.0983 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C19H22N3O4S |
Molecular Weight | 388.461 |
Charge | -1 |
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 15:08:15 UTC 2023
by
admin
on
Fri Dec 15 15:08:15 UTC 2023
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Record UNII |
95PFX5932Y
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1500
Created by
admin on Fri Dec 15 15:08:15 UTC 2023 , Edited by admin on Fri Dec 15 15:08:15 UTC 2023
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Code System | Code | Type | Description | ||
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26939-80-0
Created by
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1299048
Created by
admin on Fri Dec 15 15:08:15 UTC 2023 , Edited by admin on Fri Dec 15 15:08:15 UTC 2023
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PRIMARY | RxNorm | ||
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C65845
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95PFX5932Y
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95PFX5932Y
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SUB02502MIG
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CHEMBL1201116
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4052-56-6
Created by
admin on Fri Dec 15 15:08:15 UTC 2023 , Edited by admin on Fri Dec 15 15:08:15 UTC 2023
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m5977
Created by
admin on Fri Dec 15 15:08:15 UTC 2023 , Edited by admin on Fri Dec 15 15:08:15 UTC 2023
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PRIMARY | Merck Index | ||
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226-182-3
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757046
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100000086699
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5321-32-4
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DTXSID0045830
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23678597
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DBSALT000966
Created by
admin on Fri Dec 15 15:08:15 UTC 2023 , Edited by admin on Fri Dec 15 15:08:15 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |