Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:55 UTC
Update Date2025-03-25 00:52:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194156
Frequency0.5
Structure
Chemical FormulaC13H22N4
Molecular Mass234.1844
SMILESCNC(=N)NCCCC(N)Cc1ccccc1
InChI KeyLHKNEQOAHYMZHB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monoalkylamines
  • organopnictogen compounds
  • Substituents
  • guanidine
  • imine
  • carboximidamide
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • amphetamine or derivatives