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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:57 UTC
Update Date2025-03-21 18:33:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095463
Frequency29.0
Structure
Chemical FormulaC14H12O5
Molecular Mass260.0685
SMILESCOc1ccc2cc(C(C(=O)O)C(=O)O)ccc2c1
InChI KeyFUGZEJBONBRAQO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • alkyl aryl ethers
  • anisoles
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
    • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • carboxylic acid
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • anisole
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • organooxygen compound