Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C11H13NO3 |
| Molecular Weight | 207.2258 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)NC(=O)C1=CC=C(C=C1)C(O)=O
InChI
InChIKey=PRCGIFCKPACTDG-UHFFFAOYSA-N
InChI=1S/C11H13NO3/c1-7(2)12-10(13)8-3-5-9(6-4-8)11(14)15/h3-7H,1-2H3,(H,12,13)(H,14,15)
| Molecular Formula | C11H13NO3 |
| Molecular Weight | 207.2258 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:02:26 GMT 2025
by
admin
on
Mon Mar 31 19:02:26 GMT 2025
|
| Record UNII |
W6LXS5VI5Z
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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W6LXS5VI5Z
Created by
admin on Mon Mar 31 19:02:26 GMT 2025 , Edited by admin on Mon Mar 31 19:02:26 GMT 2025
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69903
Created by
admin on Mon Mar 31 19:02:26 GMT 2025 , Edited by admin on Mon Mar 31 19:02:26 GMT 2025
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779-47-5
Created by
admin on Mon Mar 31 19:02:26 GMT 2025 , Edited by admin on Mon Mar 31 19:02:26 GMT 2025
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DTXSID40228529
Created by
admin on Mon Mar 31 19:02:26 GMT 2025 , Edited by admin on Mon Mar 31 19:02:26 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
Major urinary metabolite.
URINE
|
