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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:02 UTC
Update Date2025-03-21 18:37:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115259
Frequency22.9
Structure
Chemical FormulaC15H20N2O2
Molecular Mass260.1525
SMILESCC(C)NCC(O)COc1ccc2ccccc2n1
InChI KeyZGAQGZPKKRHKOM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent quinolones and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkyl aryl ethers
  • azacyclic compounds
  • benzenoids
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organopnictogen compounds
  • polyhalopyridines
  • secondary alcohols
    • Substituents
  • ether
  • polyhalopyridine
  • alkyl aryl ether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • alcohol
  • secondary aliphatic amine
  • quinolone
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • secondary amine
  • pyridine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine