Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:04:51 UTC
Update Date2025-03-24 21:54:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01931044
Frequency0.6
Structure
Chemical FormulaC5H8FNO2
Molecular Mass133.0539
SMILESO=C(O)C1(F)CCCN1
InChI KeyPNTVJAVLOCULJP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-halocarboxylic acids
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • Substituents
  • alpha-halocarboxylic acid or derivatives
  • carbonyl group
  • carboxylic acid
  • amino acid
  • alpha-halocarboxylic acid
  • organohalogen compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alkyl halide
  • pyrrolidine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • alkyl fluoride
  • organofluoride
  • secondary amine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine