Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H21NO6S |
| Molecular Weight | 319.374 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C)NC[C@H](O)C1=CC=C(OS(O)(=O)=O)C(CO)=C1
InChI
InChIKey=FPMLHYFHLRTRMB-NSHDSACASA-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)/t11-/m0/s1
| Molecular Formula | C13H21NO6S |
| Molecular Weight | 319.374 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:58:24 GMT 2023
by
admin
on
Sat Dec 16 09:58:24 GMT 2023
|
| Record UNII |
38DWL97D64
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English |
| Code System | Code | Type | Description | ||
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29971173
Created by
admin on Sat Dec 16 09:58:25 GMT 2023 , Edited by admin on Sat Dec 16 09:58:25 GMT 2023
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146698-85-3
Created by
admin on Sat Dec 16 09:58:25 GMT 2023 , Edited by admin on Sat Dec 16 09:58:25 GMT 2023
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PRIMARY | |||
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38DWL97D64
Created by
admin on Sat Dec 16 09:58:25 GMT 2023 , Edited by admin on Sat Dec 16 09:58:25 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
RACEMATE -> ENANTIOMER |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
catalysed almost exclusively by sulphotransferase (SULT) 1A3
MAJOR
PLASMA
|
||
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PARENT -> METABOLITE INACTIVE |
catalysed almost exclusively by sulphotransferase (SULT) 1A3
MAJOR
PLASMA
|
