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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:36 UTC
Update Date2025-03-25 00:46:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157120
Frequency0.5
Structure
Chemical FormulaC32H49NO21
Molecular Mass783.2797
SMILESO=CC(O)C(O)C(OC1OC(CO)C(O)C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2NC(=O)Cc2ccccc2)C1O)C(O)CO
InChI KeyIJDJWDBLKRSEJA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent n-acyl-alpha-hexosamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alkyl glycosides
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • carboxylic acids and derivatives
  • fatty acyl glycosides of mono- and disaccharides
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • phenylacetamides
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl
  • fatty acyl glycoside of mono- or disaccharide
  • monocyclic benzene moiety
  • beta-hydroxy aldehyde
  • carbonyl group
  • aromatic heteromonocyclic compound
  • monosaccharide
  • carboxylic acid derivative
  • n-acyl-alpha-hexosamine
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • phenylacetamide
  • organoheterocyclic compound
  • alcohol
  • fatty acyl glycoside
  • aldehyde
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • alkyl glycoside