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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:37 UTC
Update Date2025-03-25 00:47:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159367
Frequency0.5
Structure
Chemical FormulaC11H13N3O7S
Molecular Mass331.0474
SMILESO=S(=O)(O)OCC1OC(n2cnc3cccnc32)C(O)C1O
InChI KeyLNBMVVZOGOHLQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 2-halopyridines
  • alkyl sulfates
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidazoles
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • secondary alcohols
  • sulfuric acid monoesters
  • tetrahydrofurans
    • Substituents
  • sulfuric acid monoester
  • polyhalopyridine
  • monosaccharide
  • imidazopyridine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • alkyl sulfate
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azole
  • 1,2-diol
  • n-substituted imidazole
  • alcohol
  • organic sulfuric acid or derivatives
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • pyridine
  • organic oxygen compound
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • sulfuric acid ester
  • organooxygen compound