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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:57 UTC
Update Date2025-03-21 18:35:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107787
Frequency24.9
Structure
Chemical FormulaC12H10O3
Molecular Mass202.063
SMILESCOc1ccc2c3c(ccc2c1)OCO3
InChI KeyJLXJJDKXTLIOFU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl aryl ethers
  • anisoles
  • benzodioxoles
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • phenol ether
  • ether
  • alkyl aryl ether
  • oxacycle
  • naphthalene
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • anisole
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • benzodioxole