Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:08 UTC
Update Date2025-03-21 18:41:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136638
Frequency18.3
Structure
Chemical FormulaC9H6N2O2
Molecular Mass174.0429
SMILESO=C(O)c1ccc2nccnc2c1
InChI KeyJGQDBVXRYDEWGM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinoxalines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carboxylic acids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrazines
  • Substituents
  • quinoxaline
  • carboxylic acid
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound