ChemSpider 2D Image | O-[{(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-[(11Z)-11-octadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-serine | C40H74NO10P

O-[{(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-[(11Z)-11-octadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-serine

  • Molecular FormulaC40H74NO10P
  • Average mass759.990 Da
  • Monoisotopic mass759.505005 Da
  • ChemSpider ID59695418

  • 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

11-Octadecenoic acid, (2R)-3-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-2-[[(9Z)-1-oxo-9-hexadecen-1-yl]oxy]propyl ester, (11Z)- [ACD/Index Name]
O-[{(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-[(11Z)-11-octadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-serin [German] [ACD/IUPAC Name]
O-[{(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-[(11Z)-11-octadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-serine [ACD/IUPAC Name]
O-[{(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-[(11Z)-11-octadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-sérine [French] [ACD/IUPAC Name]
(2S)-2-amino-3-({[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)propanoic acid
(2S)-2-amino-3-{[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propoxy(hydroxy)phosphoryl]oxy}propanoic acid
1-(11Z-octadecenoyl)-2-(9Z-hexadecenoyl)-sn-glycero-3-phosphoserine
1-vaccenoyl-2-palmitoleoyl-sn-glycero-3-phosphoserine
Phosphatidylserine(18:1/16:1)
Phosphatidylserine(34:2)
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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: 1.1±0.1 g/cm3
Boiling Point: 799.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.1 mmHg at 25°C
Enthalpy of Vaporization: 126.3±6.0 kJ/mol
Flash Point: 437.2±35.7 °C
Index of Refraction: 1.492
Molar Refractivity: 207.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 3
ACD/LogP: 14.03
ACD/LogD (pH 5.5): 6.65
ACD/BCF (pH 5.5): 9571.65
ACD/KOC (pH 5.5): 2489.98
ACD/LogD (pH 7.4): 6.54
ACD/BCF (pH 7.4): 7500.77
ACD/KOC (pH 7.4): 1951.26
Polar Surface Area: 181 Å2
Polarizability: 82.4±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 716.4±3.0 cm3

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