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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:22 UTC
Update Date2025-03-25 00:49:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177069
Frequency0.5
Structure
Chemical FormulaC16H18N2O
Molecular Mass254.1419
SMILESO=c1ccc2c(C3CCN4CCCC34)cccc2[nH]1
InChI KeyKBGXFHAGNSBVNG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent hydroquinolones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroquinolines
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyridines and derivatives
  • pyridinones
  • pyrrolizidines
  • trialkylamines
    • Substituents
  • lactam
  • polyhalopyridine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • pyrrolidine
  • tertiary amine
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • dihydroquinoline
  • dihydroquinolone
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • pyrrolizidine
  • organic nitrogen compound
  • pyridinone
  • amine
  • organooxygen compound