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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:29 UTC
Update Date2025-03-25 00:49:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177347
Frequency0.5
Structure
Chemical FormulaC13H14N6O6
Molecular Mass350.0975
SMILESCn1cnc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)CO)c2c1=O
InChI KeyXTJBEOWMDWZBSG-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
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • pyrazines
  • pyrimidones
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • pteridine
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound