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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:33 UTC
Update Date2025-03-21 18:31:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00087355
Frequency32.6
Structure
Chemical FormulaC16H20N2O
Molecular Mass256.1576
SMILESCN(C)CCC(O)(c1ccccc1)c1cccnc1
InChI KeyAJAPAGFKJYVVSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydroxypyridines
Direct Parent hydroxypyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • aromatic alcohols
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organopnictogen compounds
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • 1,3-aminoalcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • hydroxypyridine
  • methylpyridine
  • tertiary alcohol
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound