Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:45:11 UTC
Update Date2025-03-21 18:00:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00027084
Frequency140.6
Structure
Chemical FormulaC10H13NO2
Molecular Mass179.0946
SMILESCC(=O)C(N)Cc1ccc(O)cc1
InChI KeyGZKMJHFMJZLQHG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amphetamine or derivatives