Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:20 UTC
Update Date2025-03-25 00:52:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195090
Frequency0.5
Structure
Chemical FormulaC4H7F3OS
Molecular Mass160.017
SMILESCCCS(=O)C(F)(F)F
InChI KeyFWEQTQAPEOTZIA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classalkyl halides
Subclass halomethanes
Direct Parent trihalomethanes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • trihalomethane
  • alkyl fluoride
  • organofluoride
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • hydrocarbon derivative