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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:06 UTC
Update Date2025-03-25 00:49:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171822
Frequency0.5
Structure
Chemical FormulaC16H22N2
Molecular Mass242.1783
SMILESCN(C)CCCCNc1cccc2ccccc12
InChI KeyALVLBARBCHKTSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alkylarylamines
  • trialkylamines
    • Substituents
  • tertiary aliphatic amine
  • aromatic homopolycyclic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • naphthalene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine