| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 05:28:41 UTC |
|---|
| Update Date | 2025-03-24 14:20:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00839725 |
|---|
| Frequency | 1.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H10O2 |
|---|
| Molecular Mass | 114.0681 |
|---|
| SMILES | OCC1(O)CC=CC1 |
|---|
| InChI Key | VGVYMKYJPLYRJL-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | tertiary alcohols |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | 1,2-diolshydrocarbon derivatives |
|---|
| Substituents | tertiary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative1,2-diol |
|---|
