Found 1 result

Search term: 59662308 (Found by CSID)
ChemSpider 2D Image | (2S)-3-[(11Z,14Z)-11,14-Icosadienoyloxy]-1,2-propanediyl (5Z,8Z,11Z,14Z,17Z,5'Z,8'Z,11'Z,14'Z,17'Z)bis(-5,8,11,14,17-icosapentaenoate) | C63H98O6

(2S)-3-[(11Z,14Z)-11,14-Icosadienoyloxy]-1,2-propanediyl (5Z,8Z,11Z,14Z,17Z,5'Z,8'Z,11'Z,14'Z,17'Z)bis(-5,8,11,14,17-icosapentaenoate)

  • Molecular FormulaC63H98O6
  • Average mass951.449 Da
  • Monoisotopic mass950.736328 Da
  • ChemSpider ID59662308

  • 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

(2S)-3-[(11Z,14Z)-11,14-Icosadienoyloxy]-1,2-propandiyl-(5Z,8Z,11Z,14Z,17Z,5'Z,8'Z,11'Z,14'Z,17'Z)bis(-5,8,11,14,17-icosapentaenoat) [German] [ACD/IUPAC Name]
(2S)-3-[(11Z,14Z)-11,14-Icosadienoyloxy]-1,2-propanediyl (5Z,8Z,11Z,14Z,17Z,5'Z,8'Z,11'Z,14'Z,17'Z)bis(-5,8,11,14,17-icosapentaenoate) [ACD/IUPAC Name]
(5Z,8Z,11Z,14Z,17Z,5'Z,8'Z,11'Z,14'Z,17'Z)Bis(-5,8,11,14,17-icosapentaénoate) de (2S)-3-[(11Z,14Z)-11,14-icosadienoyloxy]-1,2-propanediyle [French] [ACD/IUPAC Name]
5,8,11,14,17-Eicosapentaenoic acid, (1S)-2-[[(11Z,14Z)-1-oxo-11,14-eicosadien-1-yl]oxy]-1-[[[(5Z,8Z,11Z,14Z,17Z)-1-oxo-5,8,11,14,17-eicosapentaen-1-yl]oxy]methyl]ethyl ester, (5Z,8Z,11Z,14Z,17Z)- [ACD/Index Name]
(2S)-1-[(11Z,14Z)-icosa-11,14-dienoyloxy]-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]propan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
1-(11Z,14Z-Eicosadienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-glycerol
1-Eicosadienoyl-2-eicosapentaenoyl-3-eicosapentaenoyl-glycerol
TAG(20:2/20:5/20:5)
TAG(20:2n6/20:5/20:5)
TAG(20:2w6/20:5/20:5)
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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: 0.9±0.1 g/cm3
Boiling Point: 862.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.4±3.0 kJ/mol
Flash Point: 315.5±34.3 °C
Index of Refraction: 1.510
Molar Refractivity: 299.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 50
#Rule of 5 Violations: 2
ACD/LogP: 21.51
ACD/LogD (pH 5.5): 17.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 17.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 118.9±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 1002.7±3.0 cm3

Click to predict properties on the Chemicalize site


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