Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:50 UTC
Update Date2025-03-21 18:31:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00088028
Frequency32.2
Structure
Chemical FormulaC22H45NO2
Molecular Mass355.345
SMILESCCCCCCCCCCCCCCCC(=O)OCCN(CC)CC
InChI KeyQZWCVMDOSCAEGE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • amino acid or derivatives
  • tertiary aliphatic amine
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound