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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:55 UTC
Update Date2025-03-25 00:47:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160012
Frequency0.5
Structure
Chemical FormulaC13H18N4O9
Molecular Mass374.1074
SMILESO=c1[nH]c(=O)n(C2OC(CO)C(O)C2O)c2[nH]c(C(O)C(O)CO)nc12
InChI KeyBHULILDUFJLHAQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • aromatic alcohol
  • lactam
  • monosaccharide
  • pyrimidone
  • purinone
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • azole
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound