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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:46 UTC
Update Date2025-03-25 00:46:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155321
Frequency0.5
Structure
Chemical FormulaC16H22N2O11
Molecular Mass418.1224
SMILESCc1cn(C2CC(O)C(COC3OC(C(=O)O)C(O)C(O)C3O)O2)c(=O)[nH]c1=O
InChI KeyFLISVGDMHAUJRC-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
  • acetals
  • azacyclic compounds
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • glucuronic acid derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • monosaccharides
  • o-glucuronides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • pyran carboxylic acids
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • glucuronic acid or derivatives
  • aromatic heteromonocyclic compound
  • o-glucuronide
  • monosaccharide
  • pyrimidone
  • carboxylic acid derivative
  • pyran carboxylic acid
  • pyrimidine
  • 1-o-glucuronide
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • organonitrogen compound
  • organopnictogen compound
  • pyrimidine nucleoside
  • oxane
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • pyran carboxylic acid or derivatives
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • hydroxy acid
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound