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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:53:01 UTC
Update Date2025-03-21 18:03:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00045804
Frequency73.4
Structure
Chemical FormulaC15H13N3O2
Molecular Mass267.1008
SMILESNC1=NC(O)=NC1(c1ccccc1)c1ccc(O)cc1
InChI KeyOVRARYRQHGOACL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • diphenylmethane
  • aromatic heteromonocyclic compound
  • azacycle
  • 1-hydroxy-2-unsubstituted benzenoid
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • organoheterocyclic compound
  • organooxygen compound