| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:46:40 UTC |
|---|
| Update Date | 2025-03-21 18:01:02 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00030518 |
|---|
| Frequency | 121.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H12O4 |
|---|
| Molecular Mass | 184.0736 |
|---|
| SMILES | COc1cc(O)cc(C(O)CO)c1 |
|---|
| InChI Key | WSLTXDRDEZJDJB-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | methoxyphenols |
|---|
| Direct Parent | methoxyphenols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesaromatic alcoholshydrocarbon derivativesmethoxybenzenesphenoxy compoundsprimary alcoholssecondary alcohols |
|---|
| Substituents | aromatic alcoholalcoholphenol ethermonocyclic benzene moietyethermethoxyphenol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativephenoxy compoundprimary alcoholorganooxygen compound1,2-diol |
|---|
