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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:03 UTC
Update Date2025-03-25 00:46:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155920
Frequency0.5
Structure
Chemical FormulaC15H22N3O+
Molecular Mass260.1757
SMILESC[N+](C)(C)C(Cc1c[nH]c2ccccc12)C(=O)CN
InChI KeyFRSYUQKQSZNHPE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha-amino ketones
  • amines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • pyrroles
  • tetraalkylammonium salts
    • Substituents
  • carbonyl group
  • indole
  • ketone
  • organic oxide
  • alpha-aminoketone
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • organic salt
  • tetraalkylammonium salt
  • azacycle
  • quaternary ammonium salt
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • amine
  • organooxygen compound