Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:26 UTC
Update Date2025-03-25 00:47:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161136
Frequency0.5
Structure
Chemical FormulaC6H10F3NO
Molecular Mass169.0714
SMILESNCC(=O)CCCC(F)(F)F
InChI KeyDEBCKNCXTGHOEX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound