Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:23:12 UTC |
---|
Update Date | 2025-03-21 18:37:57 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00118119 |
---|
Frequency | 22.1 |
---|
Structure | |
---|
Chemical Formula | C11H12O3 |
---|
Molecular Mass | 192.0786 |
---|
SMILES | CCC(=O)C(=O)Cc1ccc(O)cc1 |
---|
InChI Key | GNTUBAUJRCFPOB-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | phenols |
---|
Subclass | 1-hydroxy-2-unsubstituted benzenoids |
---|
Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | alpha-diketonesbenzene and substituted derivativeshydrocarbon derivativesorganic oxides |
---|
Substituents | monocyclic benzene moietycarbonyl group1-hydroxy-2-unsubstituted benzenoidalpha-diketoneketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
---|