Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:57 UTC
Update Date2025-03-25 00:56:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219727
Frequency0.5
Structure
Chemical FormulaC9H8N2O2
Molecular Mass176.0586
SMILESCc1c(C(=O)O)[nH]c2cnccc12
InChI KeyBLEZSOAUSMOLDR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrrole 2-carboxylic acids
  • pyrrole carboxylic acids and derivatives
  • Substituents
  • carboxylic acid
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • pyrrole-2-carboxylic acid
  • organic oxygen compound
  • pyrrole-2-carboxylic acid or derivatives
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound