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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:37 UTC
Update Date2025-03-25 00:53:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202641
Frequency0.5
Structure
Chemical FormulaC12H10N2O2
Molecular Mass214.0742
SMILESO=C(O)c1ccnc(Nc2ccccc2)c1
InChI KeyHZRCPZQBVMUEOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridinecarboxylic acids and derivatives
Direct Parent pyridinecarboxylic acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • amino acids
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidolactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • secondary amines
  • Substituents
  • monocyclic benzene moiety
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • amino acid
  • polyhalopyridine
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • imidolactam
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • secondary amine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyridine carboxylic acid
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine