Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:29 UTC
Update Date2025-03-21 18:31:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084903
Frequency33.7
Structure
Chemical FormulaC12H9NO4
Molecular Mass231.0532
SMILESO=C(Nc1ccccc1C(=O)O)c1ccco1
InChI KeyKGUJFARQLOGYHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent 2-furanilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 2-heteroaryl carboxamides
  • benzoic acids
  • benzoyl derivatives
  • furoic acid and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • furan
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • benzoyl
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • 2-furanilide
  • organonitrogen compound
  • organopnictogen compound
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • organoheterocyclic compound
  • vinylogous amide
  • furoic acid or derivatives
  • heteroaromatic compound
  • benzoic acid or derivatives
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound