| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:54:17 UTC |
|---|
| Update Date | 2025-03-25 00:51:38 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02188279 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H10O3 |
|---|
| Molecular Mass | 190.063 |
|---|
| SMILES | CC(O)=CC(=O)C(=O)c1ccccc1 |
|---|
| InChI Key | ASUJQFCEWTVJGY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzoyl derivatives |
|---|
| Direct Parent | benzoyl derivatives |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | acryloyl compoundsalpha-diketonesaryl ketonesenoneshydrocarbon derivativesorganic oxidesvinylogous acids |
|---|
| Substituents | carbonyl groupbenzoylalpha,beta-unsaturated ketonealpha-diketoneketonearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundhydrocarbon derivativeacryloyl-grouporganooxygen compoundaryl ketoneenone |
|---|
