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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:39 UTC
Update Date2025-03-25 01:00:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02243959
Frequency0.5
Structure
Chemical FormulaC38H74N2O8P+
Molecular Mass717.5177
SMILESCCCCCCCC=CCCCCCCCC(=O)NC(COP(=O)(O)OCC[N+](=O)O)C(O)CCCCCCCC=CCCCCCCC
InChI KeyPXLFTTJDDSCMNS-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phosphoethanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • c-nitro compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl phosphates
  • hydrocarbon derivatives
  • n-acyl amines
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • allyl-type 1,3-dipolar organic compound
  • fatty amide
  • carboxylic acid derivative
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • phosphoethanolamine
  • organic oxide
  • c-nitro compound
  • organonitrogen compound
  • organopnictogen compound
  • organic oxoazanium
  • alcohol
  • organic 1,3-dipolar compound
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • dialkyl phosphate
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • alkyl phosphate
  • organooxygen compound
  • organic hyponitrite