Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C11H13N3O6S |
| Molecular Weight | 315.302 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CSCCC(NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C(O)=O
InChI
InChIKey=DOHZIJDJOSBJFP-UHFFFAOYSA-N
InChI=1S/C11H13N3O6S/c1-21-5-4-9(11(15)16)12-8-3-2-7(13(17)18)6-10(8)14(19)20/h2-3,6,9,12H,4-5H2,1H3,(H,15,16)
| Molecular Formula | C11H13N3O6S |
| Molecular Weight | 315.302 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 19:36:31 GMT 2025
by
admin
on
Tue Apr 01 19:36:31 GMT 2025
|
| Record UNII |
TB6A867MZQ
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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97001
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admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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DTXSID701304121
Created by
admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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1655-53-4
Created by
admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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96404
Created by
admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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TB6A867MZQ
Created by
admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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216-740-4
Created by
admin on Tue Apr 01 19:36:31 GMT 2025 , Edited by admin on Tue Apr 01 19:36:31 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ENANTIOMER -> RACEMATE |
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ENANTIOMER -> RACEMATE |
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