| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 09:18:13 UTC |
|---|
| Update Date | 2025-03-24 20:15:50 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01390676 |
|---|
| Frequency | 0.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H6O3 |
|---|
| Molecular Mass | 126.0317 |
|---|
| SMILES | O=C1C2C=CC(O2)C1O |
|---|
| InChI Key | FVJYVIKYXSCATH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | cyclohexenones |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | dialkyl ethersfuranoneshydrocarbon derivativesketonesmonosaccharidesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
|---|
| Substituents | alcoholcyclohexenoneethertetrahydrofuranmonosaccharidedialkyl etheraliphatic heteropolycyclic compoundoxacyclesaccharideorganic oxidesecondary alcoholhydrocarbon derivative3-furanoneorganoheterocyclic compounddihydrofuran |
|---|
