Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.2625 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CCCOC1=CC2=C(CCC(=O)N2)C=C1
InChI
InChIKey=JLLAHJYNQOJXOM-UHFFFAOYSA-N
InChI=1S/C13H15NO4/c15-12-6-4-9-3-5-10(8-11(9)14-12)18-7-1-2-13(16)17/h3,5,8H,1-2,4,6-7H2,(H,14,15)(H,16,17)
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.2625 |
| 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
Tue Apr 01 21:48:33 GMT 2025
by
admin
on
Tue Apr 01 21:48:33 GMT 2025
|
| Record UNII |
9K3DEA9SHF
|
| Record Status |
Validated (UNII)
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| Record Version |
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Preferred Name | English | ||
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9K3DEA9SHF
Created by
admin on Tue Apr 01 21:48:33 GMT 2025 , Edited by admin on Tue Apr 01 21:48:33 GMT 2025
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58899-27-7
Created by
admin on Tue Apr 01 21:48:33 GMT 2025 , Edited by admin on Tue Apr 01 21:48:33 GMT 2025
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12819315
Created by
admin on Tue Apr 01 21:48:33 GMT 2025 , Edited by admin on Tue Apr 01 21:48:33 GMT 2025
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|---|---|---|---|---|
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N-Dealkylation metabolite thru CYP3A4 exposure.
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