Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:45 UTC
Update Date2025-03-25 00:56:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216927
Frequency0.5
Structure
Chemical FormulaC16H15F2N
Molecular Mass259.1173
SMILESNCCC1(c2ccc(F)cc2)Cc2cc(F)ccc21
InChI KeyPIDGJQISCIXGCN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl fluorides
  • hydrocarbon derivatives
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aryl fluoride
  • organofluoride
  • aromatic homopolycyclic compound
  • organohalogen compound
  • aryl halide
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound