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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:55 UTC
Update Date2025-03-25 00:56:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221970
Frequency0.5
Structure
Chemical FormulaC10H11N4O6P
Molecular Mass314.0416
SMILESO=c1nc[nH]c2c1cnn2C1CC2OP(=O)(O)OC2C1O
InChI KeyGWKBVKKFJWMIAM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrazolopyrimidines
Subclass pyrazolo[3,4-d]pyrimidines
Direct Parent pyrazolo[3,4-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • dioxaphospholanes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrazoles
  • pyrimidones
  • secondary alcohols
  • vinylogous amides
  • Substituents
  • pyrimidone
  • pyrazole
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • azole
  • pyrazolo[3,4-d]pyrimidine
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • 1,3_dioxaphospholane
  • cyclic alcohol
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • organooxygen compound