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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:05 UTC
Update Date2025-03-21 18:35:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108117
Frequency24.8
Structure
Chemical FormulaC19H24O6
Molecular Mass348.1573
SMILESCOc1cc(CC(CO)C(CO)Cc2cc(O)ccc2O)ccc1O
InChI KeyZFUGBBWWWFUATR-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
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • hydroquinones
  • methoxybenzenes
  • methoxyphenols
  • phenoxy compounds
  • prenylated hydroquinones
  • primary alcohols
    • Substituents
  • alcohol
  • prenylbenzoquinol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alkyl aryl ether
  • methoxybenzene
  • hydroquinone
  • aromatic homomonocyclic compound
  • dibenzylbutane lignan skeleton
  • organic oxygen compound
  • anisole
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • primary alcohol
  • organooxygen compound