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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:17 UTC
Update Date2025-03-25 01:01:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252328
Frequency0.5
Structure
Chemical FormulaC12H14N4O5
Molecular Mass294.0964
SMILESNc1ccc2c(=O)ncn(C3OC(CO)C(O)C3O)c2n1
InChI KeyNYAJTIMMLNJKRF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridopyrimidines
Subclass pyrido[2,3-d]pyrimidines
Direct Parent pyrido[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidolactams
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • primary alcohols
  • primary amines
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • polyhalopyridine
  • monosaccharide
  • pyrimidone
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • primary alcohol
  • imidolactam
  • alcohol
  • vinylogous amide
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • pyridine
  • organic oxygen compound
  • pyrido[2,3-d]pyrimidine
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound