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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:05 UTC
Update Date2025-03-25 00:55:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02210743
Frequency0.5
Structure
Chemical FormulaC16H14O4
Molecular Mass270.0892
SMILESC=CCc1ccc(Oc2ccc(O)c(C(=O)O)c2)cc1
InChI KeyHZKAUQYBZGCPPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzoic acids
  • benzoyl derivatives
  • diarylethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenol ethers
  • phenoxy compounds
  • salicylic acids
  • vinylogous acids
    • Substituents
  • diaryl ether
  • phenol ether
  • ether
  • carboxylic acid
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • salicylic acid
  • carboxylic acid derivative
  • organic oxide
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • benzoic acid or derivatives
  • hydroxybenzoic acid
  • aromatic homomonocyclic compound
  • vinylogous acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • salicylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • diphenylether
  • organooxygen compound