Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:37 UTC
Update Date2025-03-25 00:58:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230132
Frequency0.5
Structure
Chemical FormulaC10H19NO3
Molecular Mass201.1365
SMILESCCCCCC(O)=CC(N)CC(=O)O
InChI KeyGIGQYFJMEHYABG-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
  • amino fatty acids
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • medium-chain hydroxy acids and derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • amino fatty acid
  • medium-chain hydroxy acid
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • hydroxy fatty acid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound