ChemSpider 2D Image | 1-stearoyl-lysophosphatidylcholine | C26H54NO7P


  • Molecular FormulaC26H54NO7P
  • Average mass523.683 Da
  • Monoisotopic mass523.363770 Da
  • ChemSpider ID435389
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-2-Hydroxy-3-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-(stearoyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-2-hydroxy-3-[(1-oxooctadecyl)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-hydroxy-3-(stearoyloxy)propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-2-hydroxy-3-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
(2R)-2-hydroxy-3-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
(2R)-2-hydroxy-3-(stearoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
(R)-2-Hydroxy-3-(stearoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS154452 [DBID]
AIDS-154452 [DBID]
  • Miscellaneous
    • Chemical Class:

      A lysophosphatidylcholine 18:0 in which the acyl substituent is located at position 1 and is specified as stearoyl. ChEBI CHEBI:73858

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 1
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 117.96
ACD/KOC (pH 5.5): 1567.06
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 117.97
ACD/KOC (pH 7.4): 1567.11
Polar Surface Area: 115 Å2
Surface Tension:
Molar Volume:

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