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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:37 UTC
Update Date2025-03-21 18:37:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00116708
Frequency22.5
Structure
Chemical FormulaC11H8O4
Molecular Mass204.0423
SMILESO=C(O)c1cc(O)cc2ccc(O)cc12
InChI KeyYWQIVUUGLJFRHG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenecarboxylic acids and derivatives
Direct Parent naphthalenecarboxylic acids
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • hydroxybenzoic acid derivatives
  • monocarboxylic acids and derivatives
  • naphthols and derivatives
  • organic oxides
  • organooxygen compounds
    • Substituents
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-naphthalenecarboxylic acid
  • carboxylic acid derivative
  • hydroxybenzoic acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • 1-carboxy-2-haloaromatic compound
  • 2-naphthol
  • organooxygen compound