Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:02:11 UTC
Update Date2025-03-24 19:52:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01062621
Frequency1.3
Structure
Chemical FormulaC4H8FNO2
Molecular Mass121.0539
SMILESCC(N)C(F)C(=O)O
InChI KeyJSDXFYMEWCLXIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-halocarboxylic acids
  • carbonyl compounds
  • carboxylic acids
  • halogenated fatty acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • halogenated fatty acid
  • alpha-halocarboxylic acid or derivatives
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • fatty acid
  • alpha-halocarboxylic acid
  • organohalogen compound
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound