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(CO)=C(OS(O)(=O)=O)C=C1
InChI
InChIKey=FPMLHYFHLRTRMB-LLVKDONJSA-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-/m1/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
Mon Mar 31 23:05:21 GMT 2025
by
admin
on
Mon Mar 31 23:05:21 GMT 2025
|
| Record UNII |
EO86K90G5U
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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29971169
Created by
admin on Mon Mar 31 23:05:21 GMT 2025 , Edited by admin on Mon Mar 31 23:05:21 GMT 2025
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PRIMARY | |||
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146698-86-4
Created by
admin on Mon Mar 31 23:05:21 GMT 2025 , Edited by admin on Mon Mar 31 23:05:21 GMT 2025
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PRIMARY | |||
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EO86K90G5U
Created by
admin on Mon Mar 31 23:05:21 GMT 2025 , Edited by admin on Mon Mar 31 23:05:21 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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PARENT -> METABOLITE INACTIVE |