ChemSpider 2D Image | PC(P-18:1(9Z)/18:3(9Z,12Z,15Z)) | C44H80NO7P

PC(P-18:1(9Z)/18:3(9Z,12Z,15Z))

  • Molecular FormulaC44H80NO7P
  • Average mass766.082 Da
  • Monoisotopic mass765.567261 Da
  • ChemSpider ID24767587
  • 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)-3-[(1Z,9Z)-1,9-Octadecadien-1-yloxy]-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-[(1Z,9Z)-1,9-Octadecadien-1-yloxy]-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-3-[(1Z,9Z)-1,9-octadecadien-1-yloxy]-2-[[(9Z,12Z,15Z)-1-oxo-9,12,15-octadecatrien-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
PC(P-18:1(9Z)/18:3(9Z,12Z,15Z))
Phosphate de (2R)-3-[(1Z,9Z)-1,9-octadécadién-1-yloxy]-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
1-(1-Enyl-oleoyl)-2-a-linolenoyl-sn-glycero-3-phosphocholine
1-(1-Enyl-oleoyl)-2-α-linolenoyl-sn-glycero-3-phosphocholine
GPCho(18:1/18:3)
GPCho(18:1n9/18:3n3)
GPCho(18:1w9/18:3w3)
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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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 11.34
ACD/LogD (pH 5.5): 8.91
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3128557.75
ACD/LogD (pH 7.4): 8.91
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3128667.50
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

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