| Record Information |
|---|
| HMDB Status | detected |
|---|
| Creation Date | 2024-02-20 23:34:44 UTC |
|---|
| Update Date | 2025-03-21 17:56:43 UTC |
|---|
| HMDB ID | HMDB0031429 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00003208 |
|---|
| Name | 2,4-Dimethyl-3-pentanone |
|---|
| Frequency | 1838.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H14O |
|---|
| Molecular Mass | 114.1045 |
|---|
| SMILES | CC(C)C(=O)C(C)C |
|---|
| InChI Key | HXVNBWAKAOHACI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | ketones |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesorganic oxides |
|---|
| Substituents | ketonealiphatic acyclic compoundorganic oxidehydrocarbon derivative |
|---|
