Found 62 results

Search term: C46H80NO10P (Found by molecular formula)
ChemSpider 2D Image | O-(Hydroxy{(2R)-3-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyloxy]-2-[(11Z)-11-icosenoyloxy]propoxy}phosphoryl)-L-serine | C46H80NO10P

O-(Hydroxy{(2R)-3-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyloxy]-2-[(11Z)-11-icosenoyloxy]propoxy}phosphoryl)-L-serine

  • Molecular FormulaC46H80NO10P
  • Average mass838.102 Da
  • Monoisotopic mass837.552002 Da
  • ChemSpider ID74876084

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

5,8,11,14-Eicosatetraenoic acid, (2R)-3-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-2-[[(11Z)-1-oxo-11-eicosen-1-yl]oxy]propyl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
O-(Hydroxy{(2R)-3-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyloxy]-2-[(11Z)-11-icosenoyloxy]propoxy}phosphoryl)-L-serin [German] [ACD/IUPAC Name]
O-(Hydroxy{(2R)-3-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyloxy]-2-[(11Z)-11-icosenoyloxy]propoxy}phosphoryl)-L-serine [ACD/IUPAC Name]
O-(Hydroxy{(2R)-3-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyloxy]-2-[(11Z)-11-icosenoyloxy]propoxy}phosphoryl)-L-sérine [French] [ACD/IUPAC Name]
(2S)-2-amino-3-({hydroxy[(2R)-2-[(11Z)-icos-11-enoyloxy]-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propoxy]phosphoryl}oxy)propanoic acid
(2S)-2-amino-3-{[hydroxy((2R)-2-[(11Z)-icos-11-enoyloxy]-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propoxy)phosphoryl]oxy}propanoic acid
1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(11Z-eicosenoyl)-glycero-3-phosphoserine
PS(20:1_20:4)
PS(20:4(5Z,8Z,11Z,14Z)/20:1(11Z))
PS(40:5)

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: 1.1±0.1 g/cm3
Boiling Point: 848.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 133.8±6.0 kJ/mol
Flash Point: 466.6±37.1 °C
Index of Refraction: 1.504
Molar Refractivity: 235.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 3
ACD/LogP: 15.46
ACD/LogD (pH 5.5): 8.07
ACD/BCF (pH 5.5): 116563.39
ACD/KOC (pH 5.5): 14901.82
ACD/LogD (pH 7.4): 7.97
ACD/BCF (pH 7.4): 91342.29
ACD/KOC (pH 7.4): 11677.48
Polar Surface Area: 181 Å2
Polarizability: 93.5±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 796.3±3.0 cm3

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