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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:46 UTC
Update Date2025-03-25 00:54:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207581
Frequency0.5
Structure
Chemical FormulaC17H15N5O2
Molecular Mass321.1226
SMILESNc1nnc(N)c(-c2ccccc2)c1C(=O)Nc1ccc(O)cc1
InChI KeyQOHBSRONMGRAFQ-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
  • amino acids and derivatives
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • phenylpyridazines
  • primary amines
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • phenylpyridazine
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic anilide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • organoheterocyclic compound
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyridazine
  • phenol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound