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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:15 UTC
Update Date2025-03-25 01:00:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240702
Frequency0.5
Structure
Chemical FormulaC8H8N6O2
Molecular Mass220.0709
SMILESCC(=O)Nc1ncnc2c(C(N)=O)cnn12
InChI KeyVKDYBVQDCAUDFQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrazolo[1,5-a][1,3,5]triazines
Subclass pyrazolo[1,5-a][1,3,5]triazines
Direct Parent pyrazolo[1,5-a][1,3,5]triazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • aminotriazines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-acetylarylamines
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • pyrazoles
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • amino-1,3,5-triazine
  • n-acetylarylamine
  • n-arylamide
  • carboxylic acid derivative
  • pyrazole
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • azole
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • pyrazolo[1,5-a][1,3,5]triazine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • halo-s-triazine
  • triazine
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • organooxygen compound