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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:44 UTC
Update Date2025-03-21 18:36:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109696
Frequency24.4
Structure
Chemical FormulaC14H12O5
Molecular Mass260.0685
SMILESOc1cc(O)c2c(c1)CC(O)c1cc(O)cc(O)c1-2
InChI KeyHKBWCNCXSNMQFJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenanthrenes and derivatives
Subclass phenanthrenes and derivatives
Direct Parent phenanthrenes and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • naphthalenes
  • secondary alcohols
    • Substituents
  • alcohol
  • phenanthrene
  • naphthalene
  • organic oxygen compound
  • secondary alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound