Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:34 UTC
Update Date2025-03-21 18:00:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00025626
Frequency150.4
Structure
Chemical FormulaC9H13NO
Molecular Mass151.0997
SMILESCC(O)C(N)c1ccccc1
InChI KeyAAEOXZIUGCXWTF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound