| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:09:00 UTC |
|---|
| Update Date | 2025-03-21 18:30:58 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00083772 |
|---|
| Frequency | 34.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H10O |
|---|
| Molecular Mass | 158.0732 |
|---|
| SMILES | Cc1ccc(-c2ccoc2)cc1 |
|---|
| InChI Key | PCWCERNFIYTAIK-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | toluenes |
|---|
| Direct Parent | toluenes |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | furansheteroaromatic compoundshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
|---|
| Substituents | furanoxacyclearomatic heteromonocyclic compoundorganic oxygen compoundheteroaromatic compoundhydrocarbon derivativetolueneorganoheterocyclic compoundorganooxygen compound |
|---|