Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:56 UTC
Update Date2025-03-25 01:01:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246981
Frequency0.5
Structure
Chemical FormulaC10H11NO2
Molecular Mass177.079
SMILESCC=CC(=O)c1cccc(N)c1O
InChI KeyUULQOSSHBYLVAA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoyl derivatives
Direct Parent benzoyl derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • alpha,beta-unsaturated ketones
  • aryl ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous acids
  • Substituents
  • benzoyl
  • 1-hydroxy-4-unsubstituted benzenoid
  • alpha,beta-unsaturated ketone
  • ketone
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • aryl ketone