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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:21 UTC
Update Date2025-03-25 00:45:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149590
Frequency0.5
Structure
Chemical FormulaC11H19N2O+
Molecular Mass195.1492
SMILESC[N+](C)(C)CCC(O)c1ccccn1
InChI KeyNBIJPQALKCRYHM-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
  • 2-halopyridines
  • amines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • aromatic alcohol
  • alcohol
  • 1,3-aminoalcohol
  • tetraalkylammonium salt
  • aromatic heteromonocyclic compound
  • azacycle
  • quaternary ammonium salt
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound