Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:35:54 UTC
Update Date2025-03-21 17:57:08 UTC
HMDB IDHMDB0060807
Metabolite Identification
DeepMet IDDMID00005890
Namea-Methyldopamine
Frequency892.5
Structure
Chemical FormulaC9H13NO2
Molecular Mass167.0946
SMILESCC(N)Cc1ccc(O)c(O)c1
InChI KeyKSRGADMGIRTXAF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • phenylpropanes
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amphetamine or derivatives