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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:52:43 UTC
Update Date2025-03-25 00:27:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01329858
Frequency1.0
Structure
Chemical FormulaC40H67NO35
Molecular Mass1121.3494
SMILESCC(=O)NC1C(OC2C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C2O)OC(COC2(C(=O)O)OC(C(O)C(O)CO)C(O)C(O)C2O)OC1OC1C(O)C(CO)OC(OC2C(CO)OC(O)C(O)C2O)C1O
InChI KeyIOYYMLBHNBAKQC-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
  • acetamides
  • alkyl glycosides
  • alpha-hydroxyaldehydes
  • beta hydroxy acids and derivatives
  • beta-hydroxy aldehydes
  • c-glucuronides
  • carboxylic acids
  • glucuronic acid derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • ketals
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyran carboxylic acids
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl glycoside of mono- or disaccharide
  • beta-hydroxy aldehyde
  • carbonyl group
  • carboxylic acid
  • glucuronic acid or derivatives
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • acetamide
  • c-glucuronide
  • alcohol
  • pyran carboxylic acid or derivatives
  • aldehyde
  • hydroxy acid
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • meta-dioxane
  • organooxygen compound
  • alkyl glycoside