Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:29:55 UTC
Update Date2025-03-24 21:12:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01705947
Frequency0.7
Structure
Chemical FormulaC4H8FNO
Molecular Mass105.059
SMILESCNC(C)C(=O)F
InChI KeyJYCVSKHNHIXGIF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alanine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyl fluorides
  • alpha amino acids
  • carbonyl compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • organofluoride
  • acyl fluoride
  • secondary amine
  • organohalogen compound
  • acyl halide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine