| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:34:38 UTC |
|---|
| Update Date | 2025-03-21 18:46:05 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00144780 |
|---|
| Frequency | 17.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H6O3 |
|---|
| Molecular Mass | 138.0317 |
|---|
| SMILES | Oc1cccc2c1OCO2 |
|---|
| InChI Key | XRSKRSVTUVLURN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzodioxoles |
|---|
| Subclass | benzodioxoles |
|---|
| Direct Parent | benzodioxoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsbenzenoidshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
|---|
| Substituents | oxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compound1-hydroxy-2-unsubstituted benzenoidhydrocarbon derivativebenzenoid1-hydroxy-4-unsubstituted benzenoidorganooxygen compoundbenzodioxole |
|---|