Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:32 UTC
Update Date2025-03-21 17:58:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00014368
Frequency307.1
Structure
Chemical FormulaC9H13NO2
Molecular Mass167.0946
SMILESNCC(O)Cc1ccc(O)cc1
InChI KeyHFFJJYNETGILMV-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
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound