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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:11 UTC
Update Date2025-03-21 18:38:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00122798
Frequency21.0
Structure
Chemical FormulaC12H16N6O5
Molecular Mass324.1182
SMILESCC(=O)Nc1nc2c(N)ncnc2n1C1OC(CO)C(O)C1O
InChI KeyYJZIGZBNHMRWHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpurine nucleosides
Subclass purine nucleosides
Direct Parent purine nucleosides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monosaccharides
  • n-acetylarylamines
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • purines and purine derivatives
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • n-acetylarylamine
  • amino acid or derivatives
  • monosaccharide
  • n-arylamide
  • imidazopyrimidine
  • carboxylic acid derivative
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • organoheterocyclic compound
  • acetamide
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • purine nucleoside
  • heteroaromatic compound
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound