Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:12 UTC
Update Date2025-03-25 00:52:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02192558
Frequency0.5
Structure
Chemical FormulaC25H49NO4
Molecular Mass427.3662
SMILESCCCCCCCCCCCCCC(=O)OCCCCCCCCC(=O)NCCO
InChI KeyRRHHRPNUQRYHIQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent wax monoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-acylethanolamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • carboxamide group
  • n-acylethanolamine
  • carboxylic acid derivative
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • wax monoester skeleton
  • organooxygen compound
  • alkanolamine