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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:51 UTC
Update Date2025-03-25 01:01:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251352
Frequency0.5
Structure
Chemical FormulaC22H16O5
Molecular Mass360.0998
SMILESOc1ccc(-c2c(O)cc3ccc(O)c(O)c3c2-c2ccc(O)cc2)cc1
InChI KeyKMJHBFGBENUZGF-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
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • naphthols and derivatives
  • organooxygen compounds
    • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • phenylnaphthalene
  • phenol
  • hydrocarbon derivative
  • 1-naphthol
  • 2-naphthol
  • organooxygen compound