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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:18 UTC
Update Date2025-03-25 00:54:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204226
Frequency0.5
Structure
Chemical FormulaC15H14N2
Molecular Mass222.1157
SMILESc1ccc2c(c1)CC1Nc3ccccc3C1N2
InChI KeyPUVGLSQURGYUCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass hydroquinolines
Direct Parent hydroquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • indoles
  • indolines
  • organopnictogen compounds
  • secondary alkylarylamines
    • Substituents
  • azacycle
  • indole
  • indole or derivatives
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • tetrahydroquinoline
  • dihydroindole
  • amine