Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:27:40 UTC
Update Date2025-03-25 00:42:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02127307
Frequency0.6
Structure
Chemical FormulaC4H9F2NO
Molecular Mass125.0652
SMILESCC(CN)C(O)(F)F
InChI KeyUAHDXXUDRLPGKC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classalkyl halides
Subclass alkyl fluorides
Direct Parent alkyl fluorides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound