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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:23 UTC
Update Date2025-03-21 18:38:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120883
Frequency21.5
Structure
Chemical FormulaC23H22O5
Molecular Mass378.1467
SMILESCOc1ccc2cc(C3OCC4C(c5ccc(O)c(O)c5)OCC34)ccc2c1
InChI KeyJDQWSFFUOJXMJX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classfuranoid lignans
Subclass furan lignans
Direct Parent furan lignans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • benzene and substituted derivatives
  • dialkyl ethers
  • furofuran lignans
  • furofurans
  • hydrocarbon derivatives
  • naphthalenes
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • furofuran lignan skeleton
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkyl aryl ether
  • dialkyl ether
  • oxacycle
  • furan lignan skeleton
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • furofuran
  • anisole
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound