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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:20 UTC
Update Date2025-03-25 00:51:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186081
Frequency0.5
Structure
Chemical FormulaC12H16N5O8P
Molecular Mass389.0736
SMILESNc1ncnc2c1ncn2C1OP(=O)(O)OCC2OC(CO)OC2C1O
InChI KeyKMDKZOLBOGLWLF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purines and purine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • acetals
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • n-substituted imidazoles
  • organic oxides
  • organic phosphoric acids and derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • Substituents
  • meta-dioxolane
  • pyrimidine
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • organooxygen compound