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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:59 UTC
Update Date2025-03-25 00:46:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157952
Frequency0.5
Structure
Chemical FormulaC16H17FN2O6
Molecular Mass352.1071
SMILESO=C(O)Cc1cn(C2OC(CO)C(O)C2O)nc1-c1ccc(F)cc1
InChI KeyFZTOZHBDEUPVKW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpyrazole ribonucleosides and ribonucleotides
Subclass pyrazole ribonucleosides and ribonucleotides
Direct Parent pyrazole ribonucleosides and ribonucleotides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl fluorides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • fluorobenzenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • phenylpyrazoles
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • monosaccharide
  • carboxylic acid derivative
  • organohalogen compound
  • pyrazole
  • 1-ribofuranosylpyrazole
  • phenylpyrazole
  • fluorobenzene
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • azole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • organofluoride
  • heteroaromatic compound
  • aryl halide
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound