| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 02:44:46 UTC |
|---|
| Update Date | 2025-03-21 21:56:56 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00449320 |
|---|
| Frequency | 3.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H8O2 |
|---|
| Molecular Mass | 124.0524 |
|---|
| SMILES | CC=CC(=O)C(C)=C=O |
|---|
| InChI Key | FVGVVMCNCDCCNX-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 |
|---|
