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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:36 UTC
Update Date2025-03-25 01:01:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248473
Frequency0.5
Structure
Chemical FormulaC13H16N6O4
Molecular Mass320.1233
SMILESCn1c2c(N)ncnc2c2ncn(C3OC(CO)C(O)C3O)c21
InChI KeyCQKXZKALCWXEGP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolopyrimidines
Direct Parent pyrrolopyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monosaccharides
  • n-methylpyrroles
  • n-substituted imidazoles
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • substituted pyrroles
  • tetrahydrofurans
    • Substituents
  • n-methylpyrrole
  • monosaccharide
  • substituted pyrrole
  • pyrimidine
  • pyrrolopyrimidine
  • saccharide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyrrole
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound