Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:21 UTC
Update Date2025-03-25 01:01:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02250202
Frequency0.5
Structure
Chemical FormulaC12H17NO
Molecular Mass191.131
SMILESC=C(C)c1cccc(C(O)CNC)c1
InChI KeyNCZPFKLCNVDQBJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropenes
Direct Parent phenylpropenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • secondary aliphatic amine
  • secondary amine
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenylpropene
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine