ChemSpider 2D Image | 1-(1-Enyl-oleoyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine | C43H76NO7P

1-(1-Enyl-oleoyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine

  • Molecular FormulaC43H76NO7P
  • Average mass750.040 Da
  • Monoisotopic mass749.535950 Da
  • ChemSpider ID24769335

  • 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

(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatétraénoate de (9Z,17Z,21R)-27-amino-24-hydroxy-24-oxydo-19,23,25-trioxa-24λ5-phosphaheptacosa-9,17-dién-21-yle [French] [ACD/IUPAC Name]
(9Z,17Z,21R)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24λ5-phosphaheptacosa-9,17-dien-21-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
(9Z,17Z,21R)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24λ5-phosphaheptacosa-9,17-dien-21-yl-(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
1-(1-Enyl-oleoyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine
5,8,11,14-Eicosatetraenoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[(1Z,9Z)-1,9-octadecadien-1-yloxy]methyl]ethyl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
(2-aminoethoxy)[(2R)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-[(1Z,9Z)-octadeca-1,9-dien-1-yloxy]propoxy]phosphinic acid
2-aminoethoxy(2R)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-[(1Z,9Z)-octadeca-1,9-dien-1-yloxy]propoxyphosphinic acid
GPEtn(18:1/20:4)
GPEtn(18:1n9/20:4n6)
GPEtn(18:1w9/20:4w6)
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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: 1.0±0.1 g/cm3
Boiling Point: 769.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 121.8±6.0 kJ/mol
Flash Point: 418.9±35.7 °C
Index of Refraction: 1.501
Molar Refractivity: 220.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 14.67
ACD/LogD (pH 5.5): 9.29
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 194825.44
ACD/LogD (pH 7.4): 9.20
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 157261.14
Polar Surface Area: 127 Å2
Polarizability: 87.4±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 748.3±3.0 cm3

Click to predict properties on the Chemicalize site


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