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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:21 UTC
Update Date2025-03-21 18:37:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113625
Frequency23.3
Structure
Chemical FormulaC24H26O4
Molecular Mass378.1831
SMILESOCC(Cc1cccc(O)c1)C(Cc1cccc(O)c1)Cc1cccc(O)c1
InChI KeyZACBMIHWQJOGTB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classdibenzylbutane lignans
Subclass dibenzylbutane lignans
Direct Parent dibenzylbutane lignans
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • cinnamylphenols
  • hydrocarbon derivatives
  • primary alcohols
  • Substituents
  • alcohol
  • linear 1,3-diarylpropanoid
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • cinnamylphenol
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • dibenzylbutane lignan skeleton
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary alcohol
  • organooxygen compound