Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C16H21NO6S |
| Molecular Weight | 355.406 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)NCC(O)COC1=CC=C(OS(O)(=O)=O)C2=CC=CC=C12
InChI
InChIKey=ODCKICSDIPVTRM-UHFFFAOYSA-N
InChI=1S/C16H21NO6S/c1-11(2)17-9-12(18)10-22-15-7-8-16(23-24(19,20)21)14-6-4-3-5-13(14)15/h3-8,11-12,17-18H,9-10H2,1-2H3,(H,19,20,21)
| Molecular Formula | C16H21NO6S |
| Molecular Weight | 355.406 |
| 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 23:34:44 GMT 2025
by
admin
on
Mon Mar 31 23:34:44 GMT 2025
|
| Record UNII |
FRG22A758K
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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87075-33-0
Created by
admin on Mon Mar 31 23:34:44 GMT 2025 , Edited by admin on Mon Mar 31 23:34:44 GMT 2025
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135862
Created by
admin on Mon Mar 31 23:34:44 GMT 2025 , Edited by admin on Mon Mar 31 23:34:44 GMT 2025
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FRG22A758K
Created by
admin on Mon Mar 31 23:34:44 GMT 2025 , Edited by admin on Mon Mar 31 23:34:44 GMT 2025
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DTXSID201007316
Created by
admin on Mon Mar 31 23:34:44 GMT 2025 , Edited by admin on Mon Mar 31 23:34:44 GMT 2025
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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 |
MAJOR
URINE
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