| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:01:31 UTC |
|---|
| Update Date | 2025-03-21 18:06:53 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00065749 |
|---|
| Frequency | 46.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H18O |
|---|
| Molecular Mass | 178.1358 |
|---|
| SMILES | CCC=CCC1=C(C)CCC(=O)C1 |
|---|
| InChI Key | PJQIBYIYXRRTIS-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 | hydrocarbon derivativesorganic oxides |
|---|
| Substituents | cyclohexenoneorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivative |
|---|
