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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:07:36 UTC
Update Date2025-03-21 18:29:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00080454
Frequency36.1
Structure
Chemical FormulaC24H32O9
Molecular Mass464.2046
SMILESOCC(Cc1cccc(O)c1)C(COC1OC(CO)C(O)C(O)C1O)Cc1cccc(O)c1
InChI KeyQTWCNGACUYSQID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classlignan glycosides
Subclass lignan glycosides
Direct Parent lignan glycosides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • alkyl glycosides
  • benzene and substituted derivatives
  • dibenzylbutane lignans
  • fatty acyl glycosides of mono- and disaccharides
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • fatty acyl glycoside of mono- or disaccharide
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • lignan glycoside
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • 1-hydroxy-4-unsubstituted benzenoid
  • dibenzylbutane lignan skeleton
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound
  • alkyl glycoside