Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:59:16 UTC
Update Date2025-03-24 21:25:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01775811
Frequency0.7
Structure
Chemical FormulaC6H7N3O
Molecular Mass137.0589
SMILESCc1ncc(C=O)nc1N
InChI KeyANNLMDZJIJESRI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrazines
Direct Parent pyrazine carboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl-aldehydes
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • aldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrazine carboxylic acid or derivatives
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound