Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:16 UTC
Update Date2025-03-25 00:49:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02174502
Frequency0.5
Structure
Chemical FormulaC20H37NO3
Molecular Mass339.2773
SMILESCCCCCCCC=CCCCCCCCC(=O)NCC(=O)OC
InChI KeyCKIHDWDGBBQWCX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent acyl glycines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acid esters
  • alpha amino acids
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • organic oxide
  • methyl ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alpha-amino acid ester
  • carboxamide group
  • n-acyl-amine
  • n-acylglycine
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound