Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:08 UTC
Update Date2025-03-21 17:58:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00015718
Frequency275.1
Structure
Chemical FormulaC10H12O2
Molecular Mass164.0837
SMILESCc1ccc(C)c(CC(=O)O)c1
InChI KeyRUSCTNYOPQOXDJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent p-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • p-xylene
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound