| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 01:09:04 UTC |
|---|
| Update Date | 2025-03-21 19:05:09 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00225254 |
|---|
| Frequency | 9.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H8O2 |
|---|
| Molecular Mass | 136.0524 |
|---|
| SMILES | c1ccc2c(c1)COCO2 |
|---|
| InChI Key | TWSIYGATPWEKBK-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzodioxanes |
|---|
| Subclass | benzo-1,3-dioxanes |
|---|
| Direct Parent | benzo-1,3-dioxanes |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | acetalsbenzenoidshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
|---|
| Substituents | oxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidbenzo-1,3-dioxaneorganooxygen compound |
|---|
