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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:44 UTC
Update Date2025-03-25 00:45:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150532
Frequency0.5
Structure
Chemical FormulaC11H14N4O2
Molecular Mass234.1117
SMILESOc1nc2c(C(O)C3CCCN3)ccnc2[nH]1
InChI KeyKIQVXLBWZSVLOP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidazoles
  • organopnictogen compounds
  • polyhalopyridines
  • pyrrolidines
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • polyhalopyridine
  • imidazopyridine
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • pyrrolidine
  • azole
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • secondary amine
  • pyridine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine