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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:26 UTC
Update Date2025-03-21 18:33:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096690
Frequency28.6
Structure
Chemical FormulaC13H13N7O7
Molecular Mass379.0876
SMILESNc1nc2c(nc3c(=O)[nH]c(=O)nc-3n2C2OC(CO)C(O)C2O)c(=O)[nH]1
InChI KeyBCLAVUIAJGBIMS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pterins and derivatives
Direct Parent pterins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • pyrazines
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • lactam
  • monosaccharide
  • pyrimidone
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • alcohol
  • vinylogous amide
  • pterin
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyrazine
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound