ChemSpider 2D Image | PC(18:1(11Z)/22:2(13Z,16Z)) | C48H90NO8P

PC(18:1(11Z)/22:2(13Z,16Z))

  • Molecular FormulaC48H90NO8P
  • Average mass840.204 Da
  • Monoisotopic mass839.640381 Da
  • ChemSpider ID24766750

  • 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-[(13Z,16Z)-13,16-Docosadienoyloxy]-3-[(11Z)-11-octadecenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-[(13Z,16Z)-13,16-Docosadienoyloxy]-3-[(11Z)-11-octadecenoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-2-[[(13Z,16Z)-1-oxo-13,16-docosadien-1-yl]oxy]-3-[[(11Z)-1-oxo-11-octadecen-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
PC(18:1(11Z)/22:2(13Z,16Z))
Phosphate de (2R)-2-[(13Z,16Z)-13,16-docosadienoyloxy]-3-[(11Z)-11-octadecenoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-2-[(13Z,16Z)-docosa-13,16-dienoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-(11Z-octadecenoyl)-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phosphocholine
1-Vaccenoyl-2-docosadienoyl-sn-glycero-3-phosphocholine
GPCho(18:1/22:2)
GPCho(18:1n7/22:2n6)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 45
#Rule of 5 Violations: 2
ACD/LogP: 13.57
ACD/LogD (pH 5.5): 10.49
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.49
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

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