| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:53:37 UTC |
|---|
| Update Date | 2025-03-21 18:03:54 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00047265 |
|---|
| Frequency | 70.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H14O2 |
|---|
| Molecular Mass | 154.0994 |
|---|
| SMILES | CC(=O)C=CCCCC(C)=O |
|---|
| InChI Key | KRLWWWIBVSGXGK-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | acryloyl compounds |
|---|
| Direct Parent | acryloyl compounds |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | enoneshydrocarbon derivativesketonesorganic oxides |
|---|
| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxidehydrocarbon derivativeacryloyl-groupalpha,beta-unsaturated ketoneenone |
|---|
