| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:53:28 UTC |
|---|
| Update Date | 2025-03-21 18:03:51 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00046903 |
|---|
| Frequency | 71.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H12O |
|---|
| Molecular Mass | 160.0888 |
|---|
| SMILES | CC=C(C)C(=O)c1ccccc1 |
|---|
| InChI Key | AXOYGHVXGWFROM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | phenylpropanes |
|---|
| Direct Parent | phenylpropanes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alpha-branched alpha,beta-unsaturated ketonesaryl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compounds |
|---|
| Substituents | alpha-branched alpha,beta-unsaturated-ketonebenzoylalpha,beta-unsaturated ketoneketonephenylpropanearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
|---|
