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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:31:08 UTC
Update Date2025-03-25 01:27:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02411419
Frequency0.5
Structure
Chemical FormulaC29H52NO30PS
Molecular Mass957.2032
SMILESNCCOP(=O)(O)OC1CC(OC2C(O)C(OC3C(O)C(COS(=O)(=O)O)OC(OC(C(O)CO)C(O)C(O)C=O)C3O)OC(C(O)CO)C2O)(C(=O)O)OC(C(O)CO)C1O
InChI KeyDTBQKHCHKCXCAC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acyl glycosides
Direct Parent fatty acyl glycosides of mono- and disaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl glycosides
  • alkyl sulfates
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • c-glucuronides
  • carboxylic acids
  • dialkyl phosphates
  • hydrocarbon derivatives
  • ketals
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • phosphoethanolamines
  • primary alcohols
  • pyran carboxylic acids
  • secondary alcohols
  • sulfuric acid monoesters
    • Substituents
  • fatty acyl glycoside of mono- or disaccharide
  • beta-hydroxy aldehyde
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • phosphoethanolamine
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • ketal
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • c-glucuronide
  • alcohol
  • pyran carboxylic acid or derivatives
  • organic sulfuric acid or derivatives
  • aldehyde
  • oxacycle
  • dialkyl phosphate
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • pyran
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • sulfuric acid ester
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound
  • alkyl glycoside