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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:01 UTC
Update Date2025-03-25 00:57:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224500
Frequency0.5
Structure
Chemical FormulaC18H14N2O4
Molecular Mass322.0954
SMILESO=C(Nc1ccc(O)cc1)c1c(O)ccnc1-c1ccc(O)cc1
InChI KeyMINSCMRKXODULH-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-hydroxy-2-unsubstituted benzenoids
  • 2-halopyridines
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • nicotinamides
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyridinecarboxylic acids and derivatives
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • pyridine carboxylic acid or derivatives
  • aromatic heteromonocyclic compound
  • polyhalopyridine
  • nicotinamide
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic anilide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • organoheterocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • carboxamide group
  • secondary carboxylic acid amide
  • vinylogous acid
  • pyridine
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound