ChemSpider 2D Image | 1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine | C28H50NO7P

1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine

  • Molecular FormulaC28H50NO7P
  • Average mass543.673 Da
  • Monoisotopic mass543.332458 Da
  • ChemSpider ID24766532
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-2-Hydroxy-3-[(8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-[(8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine
Ethanaminium, 2-[[hydroxy[(2R)-2-hydroxy-3-[[(8Z,11Z,14Z,17Z)-1-oxo-8,11,14,17-eicosatetraen-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-hydroxy-3-[(8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-2-hydroxy-3-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-Eicsoate
1-Eicsoatetraenoyl-glycero-3-phosphocholine
1-Eicsoic acid
LPC(20:4)
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  • Miscellaneous
    • Chemical Class:

      A lysophosphatidylcholine 20:4 in which the the acyl group at position 1 is specified as (8<stereo>Z</stereo>,11<stereo>Z</stereo>,14<stereo>Z</stereo>,17<stereo>Z</stereo>)-icosatetraenoyl. ChEBI CHEBI:86259

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 1
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 7.25
ACD/KOC (pH 5.5): 212.73
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 7.25
ACD/KOC (pH 7.4): 212.74
Polar Surface Area: 115 Å2
Polarizability:
Surface Tension:
Molar Volume:

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