ChemSpider 2D Image | PS(18:0/16:1(9Z)) | C40H76NO10P

PS(18:0/16:1(9Z))

  • Molecular FormulaC40H76NO10P
  • Average mass762.006 Da
  • Monoisotopic mass761.520691 Da
  • ChemSpider ID35032477

  • 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

O-{[(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-(stearoyloxy)propoxy](hydroxy)phosphoryl}-L-serin [German] [ACD/IUPAC Name]
O-{[(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-(stearoyloxy)propoxy](hydroxy)phosphoryl}-L-serine [ACD/IUPAC Name]
O-{[(2R)-2-[(9Z)-9-Hexadecenoyloxy]-3-(stearoyloxy)propoxy](hydroxy)phosphoryl}-L-sérine [French] [ACD/IUPAC Name]
Octadecanoic acid, (2R)-3-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-2-[[(9Z)-1-oxo-9-hexadecen-1-yl]oxy]propyl ester [ACD/Index Name]
PS(18:0/16:1(9Z))
(2S)-2-amino-3-({[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)propanoic acid
(2S)-2-amino-3-{[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-(octadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}propanoic acid
1-octadecanoyl-2-(9Z-hexadecenoyl)-glycero-3-phosphoserine
1-Stearoyl-2-palmitoleoyl-sn-glycero-3-phosphoserine
Phosphatidylserine(18:0/16:1)
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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: 799.4±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: 437.3±35.7 °C
Index of Refraction: 1.487
Molar Refractivity: 207.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 3
ACD/LogP: 14.55
ACD/LogD (pH 5.5): 8.65
ACD/BCF (pH 5.5): 319524.19
ACD/KOC (pH 5.5): 30669.94
ACD/LogD (pH 7.4): 8.55
ACD/BCF (pH 7.4): 250393.19
ACD/KOC (pH 7.4): 24034.31
Polar Surface Area: 181 Å2
Polarizability: 82.4±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 722.8±3.0 cm3

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