Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 14:48:48 UTC |
---|
Update Date | 2025-03-25 00:49:39 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID02175715 |
---|
Frequency | 0.5 |
---|
Structure | |
---|
Chemical Formula | C10H12O4 |
---|
Molecular Mass | 196.0736 |
---|
SMILES | Cc1cccc(O)c1C(CO)C(=O)O |
---|
InChI Key | WLKQZHJGDSIAHY-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | phenols |
---|
Subclass | cresols |
---|
Direct Parent | meta cresols |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesprimary alcoholstoluenes |
---|
Substituents | alcoholmonocyclic benzene moietycarbonyl groupcarboxylic acidm-cresol1-hydroxy-2-unsubstituted benzenoidhydroxy acid1-hydroxy-4-unsubstituted benzenoidcarboxylic acid derivativearomatic homomonocyclic compoundbeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary alcoholtolueneorganooxygen compound |
---|