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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:17 UTC
Update Date2025-03-25 00:56:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220545
Frequency0.5
Structure
Chemical FormulaC14H12N2O4
Molecular Mass272.0797
SMILESO=C(O)COc1ccccc1NC(=O)c1ccccn1
InChI KeyVTWYGLXJNQMOMH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent aromatic anilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • 2-heteroaryl carboxamides
  • alkyl aryl ethers
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • phenoxyacetic acid derivatives
  • pyridinecarboxylic acids and derivatives
  • secondary carboxylic acid amides
  • Substituents
  • pyridine carboxylic acid or derivatives
  • phenol ether
  • phenoxyacetate
  • carbonyl group
  • ether
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • alkyl aryl ether
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • aromatic anilide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • organoheterocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound