Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:32:25 UTC
Update Date2025-03-21 20:58:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00419978
Frequency4.3
Structure
Chemical FormulaC4H8F3NO
Molecular Mass143.0558
SMILESCC(O)C(N)C(F)(F)F
InChI KeyMAINWOGXJHYRLE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound