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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:08 UTC
Update Date2025-03-25 00:47:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160490
Frequency0.5
Structure
Chemical FormulaC11H11N3O2
Molecular Mass217.0851
SMILESNc1ccc(C(=O)Nc2ccc(O)cc2)[nH]1
InChI KeyVGEKITLHBDRDPC-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-heteroaryl carboxamides
  • amino acids and derivatives
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrrole carboxamides
  • secondary carboxylic acid amides
  • Substituents
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • aromatic anilide
  • organic oxide
  • pyrrole-2-carboxylic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • pyrrole-2-carboxamide
  • organoheterocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrrole
  • phenol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound