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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:08 UTC
Update Date2025-03-25 00:50:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183336
Frequency0.5
Structure
Chemical FormulaC16H16N2O7
Molecular Mass348.0958
SMILESO=C(c1ccccc1)c1cn(C2OC(CO)C(O)C2O)c(=O)[nH]c1=O
InChI KeyANFJQBUYDIHRPP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpyrimidine nucleosides
Subclass pyrimidine nucleosides
Direct Parent pyrimidine nucleosides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl ketones
  • aryl-phenylketones
  • azacyclic compounds
  • benzoyl derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrimidinecarboxylic acids and derivatives
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • monocyclic benzene moiety
  • lactam
  • aromatic heteromonocyclic compound
  • benzoyl
  • monosaccharide
  • pyrimidone
  • pyrimidine
  • ketone
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • pyrimidine nucleoside
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • aryl-phenylketone
  • heteroaromatic compound
  • pyrimidine-5-carboxylic acid or derivatives
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • aryl ketone