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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:55 UTC
Update Date2025-03-21 18:32:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00093035
Frequency30.0
Structure
Chemical FormulaC11H19N2O2+
Molecular Mass211.1441
SMILESCc1ncc(C[N+](C)(C)C)c(CO)c1O
InChI KeyNMDGECYRSAORDI-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aralkylamines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
    • Substituents
  • aromatic alcohol
  • alcohol
  • tetraalkylammonium salt
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • quaternary ammonium salt
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • aralkylamine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound