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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:46 UTC
Update Date2025-03-25 01:00:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241866
Frequency0.5
Structure
Chemical FormulaC9H11N5O3
Molecular Mass237.0862
SMILESCC(O)C(O)c1nc2c(N)ncnc2[nH]c1=O
InChI KeyPFTFTEVAGBQMIK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pteridines and derivatives
Direct Parent pteridines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • lactams
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • lactam
  • azacycle
  • heteroaromatic compound
  • pteridine
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound
  • 1,2-diol