Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H15N2O6S2.Na |
Molecular Weight | 418.42 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@]12SCC(COC(C)=O)=C(N1C(=O)[C@H]2NC(=O)CC3=CC=CS3)C([O-])=O
InChI
InChIKey=VUFGUVLLDPOSBC-XRZFDKQNSA-M
InChI=1S/C16H16N2O6S2.Na/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10;/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23);/q;+1/p-1/t12-,15-;/m1./s1
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C16H15N2O6S2 |
Molecular Weight | 395.43 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:17:32 UTC 2023
by
admin
on
Fri Dec 15 15:17:32 UTC 2023
|
Record UNII |
C22G6EYP8B
|
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 |
C357
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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Code System | Code | Type | Description | ||
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m3251
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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PRIMARY | Merck Index | ||
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1102000
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100000090184
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admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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DTXSID30891362
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admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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58-71-9
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3542
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admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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C358
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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DBSALT000262
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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SUB01100MIG
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756667
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200-394-6
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CHEMBL617
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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23675321
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9860
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 UTC 2023
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C22G6EYP8B
Created by
admin on Fri Dec 15 15:17:32 UTC 2023 , Edited by admin on Fri Dec 15 15:17:32 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 |