| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:47:28 UTC |
|---|
| Update Date | 2025-03-21 18:01:21 UTC |
|---|
| HMDB ID | HMDB0040216 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00032460 |
|---|
| Name | 2,6,6-Trimethyl-2-cyclohexene-1,4-dione |
|---|
| Frequency | 112.4 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H12O2 |
|---|
| Molecular Mass | 152.0837 |
|---|
| SMILES | CC1=CC(=O)CC(C)(C)C1=O |
|---|
| InChI Key | AYJXHIDNNLJQDT-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 |
|---|
