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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:54 UTC
Update Date2025-03-25 00:59:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239862
Frequency0.5
Structure
Chemical FormulaC13H15NO7S
Molecular Mass329.0569
SMILESO=C1CCC(OS(=O)(=O)O)C(=O)N1CCc1ccc(O)cc1
InChI KeyUDMQSWCMRRPLIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass piperidinones
Direct Parent piperidinediones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl sulfates
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • delta lactams
  • dicarboximides
  • hydrocarbon derivatives
  • n-substituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfuric acid monoesters
    • Substituents
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • carbonyl group
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • organic oxide
  • alkyl sulfate
  • organonitrogen compound
  • organopnictogen compound
  • piperidinedione
  • dicarboximide
  • carboxylic acid imide, n-substituted
  • organic sulfuric acid or derivatives
  • azacycle
  • carboxylic acid imide
  • delta-lactam
  • organic oxygen compound
  • sulfate-ester
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • sulfuric acid ester
  • organooxygen compound