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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:29 UTC
Update Date2025-03-25 00:47:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161244
Frequency0.5
Structure
Chemical FormulaC15H17N3O
Molecular Mass255.1372
SMILESNC(Cc1c[nH]c2ccccc12)C(=O)C1CCC=N1
InChI KeyLUXUCTHCKYHBPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • ketones
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrroles
  • pyrrolines
    • Substituents
  • carbonyl group
  • azacycle
  • indole
  • imine
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • pyrroline
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound