| Record Information |
|---|
| HMDB Status | quantified |
|---|
| Creation Date | 2024-02-20 23:33:31 UTC |
|---|
| Update Date | 2025-03-21 17:56:08 UTC |
|---|
| HMDB ID | HMDB0000957 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00000289 |
|---|
| Name | Pyrocatechol |
|---|
| Frequency | 14852.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H6O2 |
|---|
| Molecular Mass | 110.0368 |
|---|
| SMILES | Oc1ccccc1O |
|---|
| InChI Key | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
|---|
| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativeshydrocarbon derivativesorganooxygen compounds |
|---|
| Substituents | aromatic homomonocyclic compoundmonocyclic benzene moietyorganic oxygen compound1-hydroxy-2-unsubstituted benzenoidhydrocarbon derivative1-hydroxy-4-unsubstituted benzenoidorganooxygen compound |
|---|