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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:23 UTC
Update Date2025-03-25 00:49:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172454
Frequency0.5
Structure
Chemical FormulaC14H24N2O3
Molecular Mass268.1787
SMILESCCC1=C(C)C(=O)NC1CCCCC(=O)NCCO
InChI KeyNVBNGBRLQPSVNP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent n-acylethanolamines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolines
  • secondary carboxylic acid amides
    • Substituents
  • alcohol
  • fatty acyl
  • carbonyl group
  • lactam
  • azacycle
  • fatty amide
  • carboxamide group
  • n-acylethanolamine
  • carboxylic acid derivative
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound