Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:12 UTC
Update Date2025-03-25 00:54:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208582
Frequency0.5
Structure
Chemical FormulaC9H12FN
Molecular Mass153.0954
SMILESCC(C)(N)c1ccc(F)cc1
InChI KeyNYFSRXOWJXAHOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
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
  • phenylpropane
  • aromatic homomonocyclic compound
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • halobenzene