Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C10H11N4O5S.Na.3H2O |
| Molecular Weight | 376.319 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.[Na+].CN1C(CC2=C\C(=N\NC(N)=O)C(=O)C=C12)S([O-])(=O)=O
InChI
InChIKey=CQGHBSBJJFZEHQ-LWUOGSMXSA-M
InChI=1S/C10H12N4O5S.Na.3H2O/c1-14-7-4-8(15)6(12-13-10(11)16)2-5(7)3-9(14)20(17,18)19;;;;/h2,4,9H,3H2,1H3,(H3,11,13,16)(H,17,18,19);;3*1H2/q;+1;;;/p-1/b12-6-;;;;
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C10H12N4O5S |
| Molecular Weight | 300.291 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Optical Activity | ( + / - ) |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:35:27 UTC 2023
by
admin
on
Sat Dec 16 05:35:27 UTC 2023
|
| Record UNII |
Y6G4426VGB
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Y6G4426VGB
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Y6G4426VGB
Created by
admin on Sat Dec 16 05:35:27 UTC 2023 , Edited by admin on Sat Dec 16 05:35:27 UTC 2023
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100000168997
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SUB182589
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admin on Sat Dec 16 05:35:27 UTC 2023 , Edited by admin on Sat Dec 16 05:35:27 UTC 2023
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2469330
Created by
admin on Sat Dec 16 05:35:27 UTC 2023 , Edited by admin on Sat Dec 16 05:35:27 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |