| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:47:13 UTC |
|---|
| Update Date | 2025-03-25 00:49:07 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02172100 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H16FNO |
|---|
| Molecular Mass | 221.1216 |
|---|
| SMILES | CN1CCC(C(=O)c2ccc(F)cc2)CC1 |
|---|
| InChI Key | ISGZTZNRWOQFNW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | alkyl-phenylketones |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | aryl alkyl ketonesaryl fluoridesazacyclic compoundsbenzoyl derivativesfluorobenzenesgamma-amino ketoneshydrocarbon derivativesorganic oxidesorganofluoridesorganooxygen compoundsorganopnictogen compoundspiperidinestrialkylamines |
|---|
| Substituents | aryl fluoridemonocyclic benzene moietyaryl alkyl ketonearomatic heteromonocyclic compoundbenzoylorganohalogen compoundfluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundgamma-aminoketoneazacycleorganofluoridetertiary aliphatic aminearyl halidehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneaminealkyl-phenylketone |
|---|
