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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:38:20 UTC
Update Date2025-03-24 20:24:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01438896
Frequency0.9
Structure
Chemical FormulaC58H113N3O8P+
Molecular Mass1010.826
SMILESCCCCCCC=CCCCCCCCC(=O)NC(COP(=O)(O)OCC[N+](C)(CCCCCCCC=CCCCCCCC)CC(=O)NCCO)C(O)CCCCCCCC=CCCCCCCC
InChI KeyYPPAPXMIIWLUSF-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl phosphates
  • hydrocarbon derivatives
  • n-acyl amines
  • n-acylethanolamines
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • phosphoethanolamines
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetraalkylammonium salts
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • phosphoethanolamine
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organic cation
  • organic salt
  • alkanolamine
  • alcohol
  • alpha-amino acid amide
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • carboxamide group
  • n-acylethanolamine
  • n-acyl-amine
  • secondary carboxylic acid amide
  • dialkyl phosphate
  • organic oxygen compound
  • phosphoric acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound