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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:46:38 UTC
Update Date2025-03-24 21:20:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01746256
Frequency0.7
Structure
Chemical FormulaC6H8N2O2
Molecular Mass140.0586
SMILESNC(O)c1ccc(O)nc1
InChI KeySMMHLUPLRJPUNQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridinecarboxylic acids and derivatives
Direct Parent nicotinamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkanolamines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • Substituents
  • aromatic alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • nicotinamide
  • heteroaromatic compound
  • hydroxypyridine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound
  • alkanolamine