Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:07:16 UTC
Update Date2025-03-21 18:29:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00079634
Frequency36.6
Structure
Chemical FormulaC15H22FN
Molecular Mass235.1736
SMILESNCCCC1(c2ccc(F)cc2)CCCCC1
InChI KeyYREFHBWFINVCKN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl fluorides
  • fluorobenzenes
  • hydrocarbon derivatives
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aryl fluoride
  • organofluoride
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • fluorobenzene
  • phenylbutylamine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • halobenzene