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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:00 UTC
Update Date2025-03-21 18:41:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134073
Frequency18.8
Structure
Chemical FormulaC7H5N3O3
Molecular Mass179.0331
SMILESO=C(O)c1cnc2[nH][nH]cc-2c1=O
InChI KeyJXOVMYMHIPMLQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrazolopyridines
Subclass pyrazolopyridines
Direct Parent pyrazolopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrazoles
  • pyridine-3-carboxylic acids
  • vinylogous amides
  • Substituents
  • pyridine carboxylic acid or derivatives
  • carboxylic acid
  • pyridine-3-carboxylic acid
  • polyhalopyridine
  • carboxylic acid derivative
  • pyrazolopyridine
  • pyrazole
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azole
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • pyridine carboxylic acid
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound