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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:37 UTC
Update Date2025-03-25 01:02:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02253045
Frequency0.5
Structure
Chemical FormulaC13H10N2O2
Molecular Mass226.0742
SMILESO=C(Nc1c[nH]c2ccccc12)c1ccco1
InChI KeyVJHWQQDWXMKNRO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-heteroaryl carboxamides
  • azacyclic compounds
  • benzenoids
  • carboxylic acids and derivatives
  • furoic acid and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrroles
  • secondary carboxylic acid amides
  • Substituents
  • furan
  • furoic acid or derivatives
  • azacycle
  • indole
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound