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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:20 UTC
Update Date2025-03-25 00:46:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158718
Frequency0.5
Structure
Chemical FormulaC20H20N2O2
Molecular Mass320.1525
SMILESOC1=NC(Cc2cccc(O)c2)C(Cc2c[nH]c3ccccc23)C1
InChI KeyAPQRZUSATJLGIQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • cyclic carboximidic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrroles
  • pyrrolines
    • Substituents
  • monocyclic benzene moiety
  • azacycle
  • indole
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • organic 1,3-dipolar compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • propargyl-type 1,3-dipolar organic compound
  • pyrroline
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound