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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:48 UTC
Update Date2025-03-25 00:47:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159763
Frequency0.5
Structure
Chemical FormulaC11H13N5O4
Molecular Mass279.0968
SMILESO=c1nc(CNC2C=CC(O)C2O)c2[nH]c(=O)[nH]c2[nH]1
InChI KeyQAVJFQSGTZEFHG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrimidones
  • secondary alcohols
  • Substituents
  • pyrimidone
  • purinone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • azole
  • 1,2-diol
  • alcohol
  • secondary aliphatic amine
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine