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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:03 UTC
Update Date2025-03-21 18:40:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129577
Frequency19.6
Structure
Chemical FormulaC12H14N4O6
Molecular Mass310.0913
SMILESNc1cc(C(=O)O)nc2c1ncn2C1OC(CO)C(O)C1O
InChI KeyIBFGBOCMTSUUTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • amino acids
  • azacyclic compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidazoles
  • monocarboxylic acids and derivatives
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • primary alcohols
  • primary amines
  • pyridine-2-carboxylic acids
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • pyridine carboxylic acid or derivatives
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • polyhalopyridine
  • monosaccharide
  • imidazopyridine
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • pyridine-2-carboxylic acid
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • primary alcohol
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • pyridine carboxylic acid
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound