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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:44 UTC
Update Date2025-03-25 00:49:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175561
Frequency0.5
Structure
Chemical FormulaC12H17FN5O7P
Molecular Mass393.085
SMILESNc1ncnc2c1ncn2CC1(CF)OC(COP(=O)(O)O)C(O)C1O
InChI KeyVZRFHZONPBLANV-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
  • 1,2-diols
  • alkyl fluorides
  • azacyclic compounds
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monoalkyl phosphates
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • ether
  • monosaccharide
  • organohalogen compound
  • dialkyl ether
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • imidolactam
  • azole
  • 1,2-diol
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • alkyl fluoride
  • organofluoride
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound