| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:38:21 UTC |
|---|
| Update Date | 2025-03-21 17:58:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00011648 |
|---|
| Frequency | 395.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H6O3 |
|---|
| Molecular Mass | 150.0317 |
|---|
| SMILES | O=CC(=O)c1ccccc1O |
|---|
| InChI Key | CFSVWTAGZWCTFT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | phenylacetaldehydes |
|---|
| Direct Parent | phenylacetaldehydes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalpha ketoaldehydesaryl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesvinylogous acids |
|---|
| Substituents | carbonyl groupbenzoyl1-hydroxy-2-unsubstituted benzenoidaldehyde1-hydroxy-4-unsubstituted benzenoidketonearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundphenolhydrocarbon derivativealpha-ketoaldehydeorganooxygen compoundaryl ketonephenylacetaldehyde |
|---|
