| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 08:52:21 UTC |
|---|
| Update Date | 2025-03-25 00:27:03 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01328933 |
|---|
| Frequency | 1.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H12O2 |
|---|
| Molecular Mass | 140.0837 |
|---|
| SMILES | COC1(C)CC=CC(=O)C1 |
|---|
| InChI Key | PIHNTHXEAKQHEE-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | cyclohexenones |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | dialkyl ethershydrocarbon derivativesorganic oxides |
|---|
| Substituents | cyclohexenoneorganic oxideetheraliphatic homomonocyclic compoundhydrocarbon derivativedialkyl ether |
|---|
