| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 05:48:08 UTC |
|---|
| Update Date | 2025-03-24 14:35:15 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00885924 |
|---|
| Frequency | 1.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H8O2 |
|---|
| Molecular Mass | 124.0524 |
|---|
| SMILES | CC(=O)C=CC(C)=C=O |
|---|
| InChI Key | YYRYUSGWMQAOLG-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 derivativesketenesketonesorganic oxidesynolates |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketoneketoneorganic oxideynolatehydrocarbon derivativeacryloyl-groupketeneenone |
|---|
