| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:40:06 UTC |
|---|
| Update Date | 2025-03-21 17:58:37 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00015643 |
|---|
| Frequency | 276.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H10O2 |
|---|
| Molecular Mass | 102.0681 |
|---|
| SMILES | COC(C)C(C)=O |
|---|
| InChI Key | DLPGPGQJLPODMY-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 | dialkyl ethershydrocarbon derivativesorganic oxides |
|---|
| Substituents | ketonealiphatic acyclic compoundorganic oxideetherhydrocarbon derivativedialkyl ether |
|---|
