Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:24 UTC
Update Date2025-03-21 18:00:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00025240
Frequency153.1
Structure
Chemical FormulaC9H13NO
Molecular Mass151.0997
SMILESCN(C)Cc1ccc(O)cc1
InChI KeyNFVPEIKDMMISQO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylmethylamines
Direct Parent phenylmethylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aralkylamines
  • benzylamines
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • aralkylamine
  • aromatic homomonocyclic compound
  • phenylmethylamine
  • organic oxygen compound
  • benzylamine
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound