Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H21NO6S |
| Molecular Weight | 319.374 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C)NCC(O)C1=CC=C(OS(O)(=O)=O)C(CO)=C1
InChI
InChIKey=FPMLHYFHLRTRMB-UHFFFAOYSA-N
InChI=1S/C13H21NO6S/c1-13(2,3)14-7-11(16)9-4-5-12(10(6-9)8-15)20-21(17,18)19/h4-6,11,14-16H,7-8H2,1-3H3,(H,17,18,19)
| Molecular Formula | C13H21NO6S |
| Molecular Weight | 319.374 |
| 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
Sat Dec 16 10:09:43 UTC 2023
by
admin
on
Sat Dec 16 10:09:43 UTC 2023
|
| Record UNII |
2CX9CN85QM
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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63908-03-2
Created by
admin on Sat Dec 16 10:09:43 UTC 2023 , Edited by admin on Sat Dec 16 10:09:43 UTC 2023
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PRIMARY | |||
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2CX9CN85QM
Created by
admin on Sat Dec 16 10:09:43 UTC 2023 , Edited by admin on Sat Dec 16 10:09:43 UTC 2023
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PRIMARY | |||
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46780103
Created by
admin on Sat Dec 16 10:09:43 UTC 2023 , Edited by admin on Sat Dec 16 10:09:43 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
IN-VIVO
URINE
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PARENT -> METABOLITE |
IN-VIVO
URINE
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