| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:35:34 UTC |
|---|
| Update Date | 2025-03-21 17:57:01 UTC |
|---|
| HMDB ID | HMDB0004062 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00005144 |
|---|
| Name | Gentisate aldehyde |
|---|
| Frequency | 1052.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H6O3 |
|---|
| Molecular Mass | 138.0317 |
|---|
| SMILES | O=Cc1cc(O)ccc1O |
|---|
| InChI Key | CLFRCXCBWIQVRN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | hydroxybenzaldehydes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsbenzoyl derivativeshydrocarbon derivativeshydroquinonesorganic oxidesorganooxygen compoundsvinylogous acids |
|---|
| Substituents | monocyclic benzene moietybenzoyl1-hydroxy-2-unsubstituted benzenoidhydroquinonearomatic homomonocyclic compoundvinylogous acidorganic oxidephenolhydrocarbon derivativebenzenoidhydroxybenzaldehyde |
|---|
