Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:17 UTC
Update Date2025-03-25 01:00:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245468
Frequency0.5
Structure
Chemical FormulaC12H20N2
Molecular Mass192.1626
SMILESCCN(CC)CCNc1ccccc1
InChI KeyQUMIGAREEPSVLG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent phenylalkylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alkylarylamines
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • tertiary aliphatic amine
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • organopnictogen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • benzenoid
  • tertiary amine