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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:49 UTC
Update Date2025-03-21 18:03:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00045317
Frequency74.4
Structure
Chemical FormulaC5H10O9S
Molecular Mass246.0046
SMILESO=C(O)C(O)C(O)C(O)COS(=O)(=O)O
InChI KeyNOVUMBYOCLMZGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent sulfated fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl sulfates
  • alpha hydroxy acids and derivatives
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • sulfuric acid monoesters
    • Substituents
  • aliphatic acyclic compound
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • alpha-hydroxy acid
  • monosaccharide
  • carboxylic acid derivative
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • alkyl sulfate
  • hydroxy fatty acid
  • alcohol
  • organic sulfuric acid or derivatives
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfated fatty acid
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organooxygen compound