Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:09 UTC
Update Date2025-03-21 17:59:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020128
Frequency201.9
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESCOC(=O)C(C)c1ccc(O)cc1
InChI KeyQOHGMEYPUKSMST-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound