| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:21:09 UTC |
|---|
| Update Date | 2025-03-25 01:01:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02249746 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H11NO3 |
|---|
| Molecular Mass | 181.0739 |
|---|
| SMILES | Cc1cc(O)cc(O)c1C(=O)CN |
|---|
| InChI Key | WUGURZSFVYIHQP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | alkyl-phenylketones |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesmeta cresolsmonoalkylaminesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsresorcinolstoluenesvinylogous acids |
|---|
| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidresorcinolorganic oxideorganonitrogen compoundorganopnictogen compoundm-cresol1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundvinylogous acidphenolhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundtoluenealkyl-phenylketone |
|---|
