Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:36:30 UTC
Update Date2025-03-24 21:15:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01721737
Frequency0.7
Structure
Chemical FormulaC3H7F2NO
Molecular Mass111.0496
SMILESNCCC(O)(F)F
InChI KeyALKDNHVBIDJOOH-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