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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:18 UTC
Update Date2025-03-25 00:50:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179188
Frequency0.5
Structure
Chemical FormulaC19H20O6
Molecular Mass344.126
SMILESCOc1ccc(C2C(=O)c3cc(O)cc(O)c3C(C)C2O)cc1OC
InChI KeyDGCRNJGSXLJJCX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass phenylnaphthalenes
Direct Parent phenylnaphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • aryl alkyl ketones
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • organic oxides
  • phenoxy compounds
  • secondary alcohols
  • tetralins
    • Substituents
  • tetralin
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • aryl alkyl ketone
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • ketone
  • dimethoxybenzene
  • organic oxide
  • o-dimethoxybenzene
  • alcohol
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • methoxybenzene
  • organic oxygen compound
  • phenylnaphthalene
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound
  • aryl ketone