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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:10 UTC
Update Date2025-03-25 00:49:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02174287
Frequency0.5
Structure
Chemical FormulaC19H35N2O5+
Molecular Mass371.254
SMILESCCCCCCCCCC=CC(=O)OC(CC(=O)NCCO)C[N+](C)=O
InChI KeyKIOVTWIPTIOHMK-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent n-acylethanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • aminoxides
  • carbonyl compounds
  • enoate esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • organic oxide
  • organopnictogen compound
  • organic cation
  • organic oxoazanium
  • enoate ester
  • alcohol
  • carboxamide group
  • n-acylethanolamine
  • n-acyl-amine
  • secondary carboxylic acid amide
  • fatty acid ester
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aminoxide
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound