| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 02:57:32 UTC |
|---|
| Update Date | 2025-03-21 22:02:31 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00479207 |
|---|
| Frequency | 3.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H7NO |
|---|
| Molecular Mass | 133.0528 |
|---|
| SMILES | Cc1cccc2ocnc12 |
|---|
| InChI Key | VATOOGHIVDLALN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzoxazoles |
|---|
| Subclass | benzoxazoles |
|---|
| Direct Parent | benzoxazoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsoxazoles |
|---|
| Substituents | azacyclebenzoxazoleheteroaromatic compoundoxazoleoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundazole |
|---|
