Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C12H19NO12S3 |
| Molecular Weight | 465.474 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C)NCC(OS(O)(=O)=O)C1=CC(OS(O)(=O)=O)=CC(OS(O)(=O)=O)=C1
InChI
InChIKey=GIEHXBUAIYADEO-UHFFFAOYSA-N
InChI=1S/C12H19NO12S3/c1-12(2,3)13-7-11(25-28(20,21)22)8-4-9(23-26(14,15)16)6-10(5-8)24-27(17,18)19/h4-6,11,13H,7H2,1-3H3,(H,14,15,16)(H,17,18,19)(H,20,21,22)
| Molecular Formula | C12H19NO12S3 |
| Molecular Weight | 465.474 |
| 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
Mon Mar 31 22:24:59 GMT 2025
by
admin
on
Mon Mar 31 22:24:59 GMT 2025
|
| Record UNII |
LUE52L2793
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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91810667
Created by
admin on Mon Mar 31 22:24:59 GMT 2025 , Edited by admin on Mon Mar 31 22:24:59 GMT 2025
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PRIMARY | |||
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LUE52L2793
Created by
admin on Mon Mar 31 22:24:59 GMT 2025 , Edited by admin on Mon Mar 31 22:24:59 GMT 2025
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1273567-82-0
Created by
admin on Mon Mar 31 22:24:59 GMT 2025 , Edited by admin on Mon Mar 31 22:24:59 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |