Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:51 UTC
Update Date2025-03-25 00:54:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205475
Frequency0.5
Structure
Chemical FormulaC4H3F8NO3S
Molecular Mass296.9706
SMILESNC(F)(C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)O
InChI KeyXZXWMAROWXHHQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organosulfonic acids and derivatives
Direct Parent organosulfonic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfonyls
  • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organosulfonic acid
  • organosulfur compound
  • organohalogen compound
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound