Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:24 UTC
Update Date2025-03-21 18:39:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00128013
Frequency19.9
Structure
Chemical FormulaC11H15NO2
Molecular Mass193.1103
SMILESCOc1ccc2c(c1)C(O)CN(C)C2
InChI KeyJLHBDDQSPYGBFO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • alkyl aryl ethers
  • anisoles
  • aralkylamines
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • phenol ether
  • ether
  • azacycle
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • alkyl aryl ether
  • aralkylamine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • tetrahydroisoquinoline
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound