Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:15 UTC
Update Date2025-03-25 00:46:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156369
Frequency0.5
Structure
Chemical FormulaC11H16NO+
Molecular Mass178.1226
SMILESC[N+]1(C)CCC(O)c2ccccc21
InChI KeyVKIWQXDEBCVESS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass hydroquinolines
Direct Parent hydroquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amines
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • quaternary ammonium salts
  • secondary alcohols
  • Substituents
  • alcohol
  • azacycle
  • quaternary ammonium salt
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organic cation
  • organic salt
  • tetrahydroquinoline
  • amine
  • organooxygen compound