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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:05 UTC
Update Date2025-03-25 00:49:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171780
Frequency0.5
Structure
Chemical FormulaC19H25N3
Molecular Mass295.2048
SMILESCN(C)CCC(c1cccnc1)C1NCCc2ccccc21
InChI KeyHRGBGVSEDDFKEU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • secondary amine
  • pyridine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • tetrahydroisoquinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine