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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:28 UTC
Update Date2025-03-21 18:06:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00060942
Frequency51.2
Structure
Chemical FormulaC14H11NO3
Molecular Mass241.0739
SMILESNc1ccccc1C(=O)c1ccccc1C(=O)O
InChI KeyKORKIRUGUNPQML-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
  • amino acids
  • aryl ketones
  • aryl-phenylketones
  • benzoic acids
  • benzoyl derivatives
  • diphenylmethanes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
    • Substituents
  • diphenylmethane
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • benzoyl
  • carboxylic acid derivative
  • benzophenone
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • vinylogous amide
  • aryl-phenylketone
  • benzoic acid or derivatives
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • aryl ketone