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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:47 UTC
Update Date2025-03-21 17:59:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00019291
Frequency212.6
Structure
Chemical FormulaC10H14N5O7P
Molecular Mass347.0631
SMILESNc1ncnc2c1cnn2C1OC(COP(=O)(O)O)C(O)C1O
InChI KeyCLUJXBCSXBGXAZ-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
  • 1,2-diols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyrazoles
  • pyrazolo[3,4-d]pyrimidines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • pentose phosphate
  • pentose-5-phosphate
  • pyrazole
  • pyrimidine
  • organic oxide
  • pyrazolopyrimidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • organoheterocyclic compound
  • azole
  • 1,2-diol
  • pyrazolo[3,4-d]pyrimidine
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate