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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:42 UTC
Update Date2025-03-25 01:01:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248716
Frequency0.5
Structure
Chemical FormulaC9H8N2O2
Molecular Mass176.0586
SMILESCc1nccc2c[nH]c(C(=O)O)c12
InChI KeyHBHWBBLZFBVARV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyridines
Subclass pyrrolopyridines
Direct Parent pyrrolopyridines
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
  • pyrrole 2-carboxylic acids
  • pyrrole carboxylic acids and derivatives
  • Substituents
  • carboxylic acid
  • azacycle
  • pyrrolopyridine
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • pyridine
  • pyrrole-2-carboxylic acid
  • organic oxygen compound
  • pyrrole-2-carboxylic acid or derivatives
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound