Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:57 UTC
Update Date2025-03-21 18:34:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00100366
Frequency27.3
Structure
Chemical FormulaC7H8N4O3
Molecular Mass196.0596
SMILESCn1c(=O)n(C)c2c(=O)[nH][nH]c(=O)c21
InChI KeyCHXHHFJYWHZFLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyridazines and derivatives
Direct Parent pyridazinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • ureas
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • urea
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • pyridazinone
  • organic nitrogen compound
  • organooxygen compound
  • azole
  • n-substituted imidazole