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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:58 UTC
Update Date2025-03-25 00:48:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02166985
Frequency0.5
Structure
Chemical FormulaC8H9N5O2
Molecular Mass207.0756
SMILESCC(=O)c1nc2c(=O)nc(N)[nH]c2n1C
InChI KeyWYWKIAQMXGEOKB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent hypoxanthines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • purines and purine derivatives
  • pyrimidones
  • vinylogous amides
  • Substituents
  • aryl alkyl ketone
  • pyrimidone
  • pyrimidine
  • ketone
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • azole
  • n-substituted imidazole
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • hypoxanthine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • aryl ketone