| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:35:36 UTC |
|---|
| Update Date | 2025-03-21 17:57:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00005230 |
|---|
| Frequency | 1031.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H12O2 |
|---|
| Molecular Mass | 152.0837 |
|---|
| SMILES | OCC(O)Cc1ccccc1 |
|---|
| InChI Key | JHWQMXKQJVAWKI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzene and substituted derivatives |
|---|
| Direct Parent | benzene and substituted derivatives |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1,2-diolshydrocarbon derivativesprimary alcoholssecondary alcohols |
|---|
| Substituents | alcoholaromatic homomonocyclic compoundmonocyclic benzene moietyorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound1,2-diol |
|---|
