Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:06 UTC
Update Date2025-03-25 00:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171815
Frequency0.5
Structure
Chemical FormulaC17H26FN
Molecular Mass263.2049
SMILESCN(C)CCCC1(c2cccc(F)c2)CCCCC1
InChI KeyYQTSVRSFGRIMNM-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
  • organofluorides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aryl fluoride
  • organofluoride
  • tertiary aliphatic amine
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • fluorobenzene
  • phenylbutylamine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • amine
  • tertiary amine