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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:49 UTC
Update Date2025-03-25 00:47:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159802
Frequency0.5
Structure
Chemical FormulaC11H16N2O6S
Molecular Mass304.0729
SMILESO=c1nc(SCCO)ccn1C1OC(CO)C(O)C1O
InChI KeyGGFFAPFLJIKBCE-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
  • alkylarylthioethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrimidones
  • secondary alcohols
  • sulfenyl compounds
  • tetrahydrofurans
  • Substituents
  • aromatic heteromonocyclic compound
  • monosaccharide
  • pyrimidone
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • pyrimidine
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • pyrimidine nucleoside
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • carbonic acid derivative
  • sulfenyl compound
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • thioether
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound