Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:11 UTC
Update Date2025-03-25 00:59:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240523
Frequency0.5
Structure
Chemical FormulaC3H7F2NO
Molecular Mass111.0496
SMILESNC(CO)C(F)F
InChI KeyMCLRDRPCZXKUTE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent primary 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
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol