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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:18 UTC
Update Date2025-03-25 00:46:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158671
Frequency0.5
Structure
Chemical FormulaC13H10O4
Molecular Mass230.0579
SMILESOC1c2cccc3ccc4c(c23)OC(O4)C1O
InChI KeyWCFVTLMCAJLQSR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • acetals
  • benzodioxoles
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • naphthalene
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • benzodioxole
  • 1,2-diol