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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:11 UTC
Update Date2025-03-25 00:51:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185739
Frequency0.5
Structure
Chemical FormulaC16H23N5O10
Molecular Mass445.1445
SMILESNc1nc2c(nc(OC3OC(CO)C(O)C3O)n2C2C(O)C(O)C(CO)C2O)c(=O)[nH]1
InChI KeyXWFFBIIXGGEWIZ-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
  • acetals
  • azacyclic compounds
  • cyclitols and derivatives
  • cyclopentanols
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hypoxanthines
  • imidazoles
  • lactams
  • monosaccharides
  • n-substituted imidazoles
  • nucleoside and nucleotide analogues
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • purines and purine derivatives
  • pyrimidones
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • lactam
  • monosaccharide
  • pyrimidone
  • imidazopyrimidine
  • pyrimidine
  • saccharide
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • vinylogous amide
  • azacycle
  • tetrahydrofuran
  • purine nucleoside
  • heteroaromatic compound
  • cyclitol or derivatives
  • cyclic alcohol
  • cyclopentanol
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hypoxanthine
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound