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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:35 UTC
Update Date2025-03-25 00:46:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154876
Frequency0.5
Structure
Chemical FormulaC16H14O5
Molecular Mass286.0841
SMILESCOc1ccc(C(=O)c2ccccc2C(=O)O)cc1OC
InChI KeyJHTVYIWHBYDCDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzophenones
Direct Parent benzophenones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • alkyl aryl ethers
  • anisoles
  • aryl ketones
  • aryl-phenylketones
  • benzoic acids
  • benzoyl derivatives
  • dimethoxybenzenes
  • diphenylmethanes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
    • Substituents
  • diphenylmethane
  • phenol ether
  • ether
  • carboxylic acid
  • benzoyl
  • alkyl aryl ether
  • carboxylic acid derivative
  • benzophenone
  • ketone
  • dimethoxybenzene
  • organic oxide
  • o-dimethoxybenzene
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • aryl-phenylketone
  • benzoic acid or derivatives
  • methoxybenzene
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound
  • aryl ketone