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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:59 UTC
Update Date2025-03-25 00:57:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224421
Frequency0.5
Structure
Chemical FormulaC11H17NO11S
Molecular Mass371.0522
SMILESO=C(O)C1=CN(C2OC(COS(=O)(=O)O)C(O)C2O)C(O)C(O)C1
InChI KeyUIODNNJTQWIYCX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • alkyl sulfates
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • sulfuric acid monoesters
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • alkanolamine
  • alcohol
  • vinylogous amide
  • organic sulfuric acid or derivatives
  • azacycle
  • tetrahydrofuran
  • tetrahydropyridine
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • sulfuric acid ester
  • organooxygen compound