| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 04:52:06 UTC |
|---|
| Update Date | 2025-03-24 14:04:58 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00751592 |
|---|
| Frequency | 2.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H6O3 |
|---|
| Molecular Mass | 126.0317 |
|---|
| SMILES | CC(=O)C=CC(O)=C=O |
|---|
| InChI Key | MMQIEIDTERECLC-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 oxidesynolates |
|---|
| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxideynolatehydrocarbon derivativeacryloyl-groupalpha,beta-unsaturated ketoneenone |
|---|
