Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:34 UTC
Update Date2025-03-21 18:03:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00044722
Frequency75.6
Structure
Chemical FormulaC9H13NO
Molecular Mass151.0997
SMILESCc1cccc(CCN)c1O
InChI KeyJVPHBVRBYDPJRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent ortho cresols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • toluenes
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • o-cresol
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • toluene
  • organooxygen compound