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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:03 UTC
Update Date2025-03-25 00:50:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178642
Frequency0.5
Structure
Chemical FormulaC11H13N4O6P
Molecular Mass328.0573
SMILESCc1cnc2c(ncn2C2OC3COP(=O)(O)OC3C2O)n1
InChI KeyRTKGWFDKNPUADJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent pentose phosphates
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidazopyrazines
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organic phosphoric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrazines
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • imidazopyrazine
  • pentose phosphate
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • pyrazine
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative