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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:59 UTC
Update Date2025-03-21 18:40:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129401
Frequency29.9
Structure
Chemical FormulaC14H12N2O2
Molecular Mass240.0899
SMILESCOc1ccc2nc(-c3ccc(O)cc3)[nH]c2c1
InChI KeyDADMNEOAKBEOHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzimidazoles
Subclass phenylbenzimidazoles
Direct Parent phenylbenzimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organonitrogen compounds
  • organopnictogen compounds
  • phenylimidazoles
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • azacycle
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • anisole
  • 2-phenylimidazole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • azole
  • phenylbenzimidazole