| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:10:00 UTC |
|---|
| Update Date | 2025-03-25 00:57:23 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02224455 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C18H14O6 |
|---|
| Molecular Mass | 326.079 |
|---|
| SMILES | O=C(O)C(=O)CC(C(=O)O)c1cccc(C(=O)c2ccccc2)c1 |
|---|
| InChI Key | RHFVFULLWQBUMP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzophenones |
|---|
| Direct Parent | benzophenones |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alpha-hydroxy ketonesalpha-keto acids and derivativesaryl ketonesaryl-phenylketonesbenzoyl derivativescarboxylic acidsdicarboxylic acids and derivativesdiphenylmethanesgamma-keto acids and derivativeshydrocarbon derivativesorganic oxides |
|---|
| Substituents | diphenylmethanecarbonyl groupcarboxylic acidaryl-phenylketonebenzoylalpha-hydroxy ketonecarboxylic acid derivativebenzophenonegamma-keto acidketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundketo acidalpha-keto aciddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compoundaryl ketone |
|---|
