Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:37 UTC
Update Date2025-03-25 00:53:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200414
Frequency0.5
Structure
Chemical FormulaC16H28ClN7
Molecular Mass353.2095
SMILESN=C(N)NCCNCCCCCCNC(=N)Nc1ccc(Cl)cc1
InChI KeyFAZZYFNJOQOWKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent chlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • carboximidamides
  • dialkylamines
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organochlorides
  • organopnictogen compounds
  • Substituents
  • aryl chloride
  • chlorobenzene
  • secondary aliphatic amine
  • guanidine
  • imine
  • organochloride
  • carboximidamide
  • secondary amine
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine