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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:20 UTC
Update Date2025-03-25 00:54:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204307
Frequency0.5
Structure
Chemical FormulaC25H28O11
Molecular Mass504.1632
SMILESOCC1OC(Oc2ccc(C3OCC4C(c5ccc6c(c5)OCO6)OCC34)cc2O)C(O)C(O)C1O
InChI KeyWRXFNBLQLDCLSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classlignan glycosides
Subclass lignan glycosides
Direct Parent lignan glycosides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • alkyl glycosides
  • benzodioxoles
  • dialkyl ethers
  • fatty acyl glycosides of mono- and disaccharides
  • furan lignans
  • furofuran lignans
  • furofurans
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • fatty acyl glycoside of mono- or disaccharide
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • furofuran lignan skeleton
  • lignan glycoside
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • dialkyl ether
  • saccharide
  • acetal
  • aromatic heteropolycyclic compound
  • furofuran
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • benzodioxole
  • alcohol
  • tetrahydrofuran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • furan lignan skeleton
  • organic oxygen compound
  • furanoid lignan
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound
  • alkyl glycoside