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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:12 UTC
Update Date2025-03-25 00:45:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149252
Frequency0.5
Structure
Chemical FormulaC11H18O13S
Molecular Mass390.0468
SMILESO=C(O)CCC(=O)OCOC1OC(COS(=O)(=O)O)C(O)C(O)C1O
InChI KeyOLBAKOHOJNPCFL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsaccharolipids
Subclass saccharolipids
Direct Parent saccharolipids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alkyl sulfates
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • sulfated fatty acids
  • sulfuric acid monoesters
    • Substituents
  • fatty acyl
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • heterocyclic fatty acid
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • acetal
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • hydroxy fatty acid
  • oxane
  • organoheterocyclic compound
  • alcohol
  • organic sulfuric acid or derivatives
  • oxacycle
  • fatty acid ester
  • organic oxygen compound
  • sulfated fatty acid
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • saccharolipid
  • organooxygen compound