ChemSpider 2D Image | {1-O-hexadecanoyl-2-O-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}serine | C40H76NO10P

{1-O-hexadecanoyl-2-O-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}serine

  • Molecular FormulaC40H76NO10P
  • Average mass762.006 Da
  • Monoisotopic mass761.520691 Da
  • ChemSpider ID4446618
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres


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

{1-O-hexadecanoyl-2-O-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}serine
9-Octadecenoic acid, (1R)-2-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9Z)- [ACD/Index Name]
O-{Hydroxy[(2R)-2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propoxy]phosphoryl}-L-serin [German] [ACD/IUPAC Name]
O-{Hydroxy[(2R)-2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propoxy]phosphoryl}-L-serine [ACD/IUPAC Name]
O-{Hydroxy[(2R)-2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propoxy]phosphoryl}-L-sérine [French] [ACD/IUPAC Name]
(2S)-2-amino-3-({[(2R)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)propanoic acid
(2S)-2-amino-3-{[(2R)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propoxy(hydroxy)phosphoryl]oxy}propanoic acid
1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine
1-Palmitoyl-2-oleoylglycero-3-phosphoserine
1-Palmitoyl-2-oleoyl-glycero-3-phosphoserine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

LMGP03010024 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

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): 8.61
ACD/BCF (pH 5.5): 300095.28
ACD/KOC (pH 5.5): 29323.19
ACD/LogD (pH 7.4): 8.51
ACD/BCF (pH 7.4): 235167.84
ACD/KOC (pH 7.4): 22978.94
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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