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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:25 UTC
Update Date2025-03-25 00:47:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163395
Frequency0.5
Structure
Chemical FormulaC12H10N2O3
Molecular Mass230.0691
SMILESO=C(Nc1ccccc1C(=O)O)c1ccc[nH]1
InChI KeyXYYCFMRMTICCHI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent aromatic anilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 2-heteroaryl carboxamides
  • azacyclic compounds
  • benzoic acids
  • benzoyl derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrrole carboxamides
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • benzoyl
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • aromatic anilide
  • organic oxide
  • pyrrole-2-carboxylic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • pyrrole-2-carboxamide
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • organoheterocyclic compound
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • benzoic acid or derivatives
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound