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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:55:36 UTC
Update Date2025-03-24 22:25:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01191724
Frequency1.1
Structure
Chemical FormulaC31H52O28
Molecular Mass872.2645
SMILESO=CC(O)C(O)C(OC1OC(CO)C(O)C(OC2OC(CO)C(OC3OC(COC4(C(=O)O)OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C(CO)O2)C1O)C(O)CO
InChI KeyQHOOMHSJTSUZRL-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
  • 1,3-dioxanes
  • alkyl glycosides
  • alpha-hydroxyaldehydes
  • beta hydroxy acids and derivatives
  • beta-hydroxy aldehydes
  • carboxylic acid orthoesters
  • carboxylic acids
  • fatty alcohols
  • glucuronic acid derivatives
  • hydrocarbon derivatives
  • ketals
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • ortho esters
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • fatty acyl glycoside of mono- or disaccharide
  • beta-hydroxy aldehyde
  • carbonyl group
  • carboxylic acid
  • glucuronic acid or derivatives
  • ortho ester
  • monosaccharide
  • carboxylic acid orthoester
  • carboxylic acid derivative
  • pyran carboxylic acid
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • fatty alcohol
  • ketal
  • aliphatic heteromonocyclic compound
  • orthocarboxylic acid derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • pyran carboxylic acid or derivatives
  • aldehyde
  • hydroxy acid
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound
  • alkyl glycoside