Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H22N4O4S |
| Molecular Weight | 330.403 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC(NCCSCC1=CC=C(C[N+](C)(C)[O-])O1)=C[N+]([O-])=O
InChI
InChIKey=DFJVUWAHTQPQCV-UHFFFAOYSA-N
InChI=1S/C13H22N4O4S/c1-14-13(8-16(18)19)15-6-7-22-10-12-5-4-11(21-12)9-17(2,3)20/h4-5,8,14-15H,6-7,9-10H2,1-3H3
| Molecular Formula | C13H22N4O4S |
| Molecular Weight | 330.403 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:32:09 UTC 2023
by
admin
on
Sat Dec 16 05:32:09 UTC 2023
|
| Record UNII |
K131L1Z4KY
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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73857-20-2
Created by
admin on Sat Dec 16 05:32:10 UTC 2023 , Edited by admin on Sat Dec 16 05:32:10 UTC 2023
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62985
Created by
admin on Sat Dec 16 05:32:10 UTC 2023 , Edited by admin on Sat Dec 16 05:32:10 UTC 2023
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DTXSID50891465
Created by
admin on Sat Dec 16 05:32:10 UTC 2023 , Edited by admin on Sat Dec 16 05:32:10 UTC 2023
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K131L1Z4KY
Created by
admin on Sat Dec 16 05:32:10 UTC 2023 , Edited by admin on Sat Dec 16 05:32:10 UTC 2023
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C038169
Created by
admin on Sat Dec 16 05:32:10 UTC 2023 , Edited by admin on Sat Dec 16 05:32:10 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE INACTIVE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
UNSPECIFIED
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
