ChemSpider 2D Image | PS(18:2(9Z,12Z)/18:2(9Z,12Z)) | C42H74NO10P

PS(18:2(9Z,12Z)/18:2(9Z,12Z))

  • Molecular FormulaC42H74NO10P
  • Average mass784.011 Da
  • Monoisotopic mass783.505005 Da
  • ChemSpider ID7826036

  • 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

9,12-Octadecadienoic acid, (1R)-1-[[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, (9Z,12Z,9'Z,12'Z)- [ACD/Index Name]
O-[{(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}(hydroxy)phosphoryl]-L-serin [German] [ACD/IUPAC Name]
O-[{(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}(hydroxy)phosphoryl]-L-serine [ACD/IUPAC Name]
O-[{(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}(hydroxy)phosphoryl]-L-sérine [French] [ACD/IUPAC Name]
PS(18:2(9Z,12Z)/18:2(9Z,12Z))
(2S)-2-amino-3-({[(2R)-2,3-bis[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy](hydroxy)phosphoryl}oxy)propanoic acid
(2S)-2-amino-3-{[(2R)-2,3-bis[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy(hydroxy)phosphoryl]oxy}propanoic acid
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoserine
1,2-Dilinoleoyl-rac-glycero-3-phosphoserine
1,2-Dilinoleoyl-sn-glycero-3-phospho-L-serine
More...

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

LMGP03010023 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 815.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 128.8±6.0 kJ/mol
Flash Point: 447.1±37.1 °C
Index of Refraction: 1.502
Molar Refractivity: 217.3±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 3
ACD/LogP: 14.06
ACD/LogD (pH 5.5): 6.79
ACD/BCF (pH 5.5): 12216.83
ACD/KOC (pH 5.5): 2965.16
ACD/LogD (pH 7.4): 6.68
ACD/BCF (pH 7.4): 9573.64
ACD/KOC (pH 7.4): 2323.63
Polar Surface Area: 181 Å2
Polarizability: 86.2±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 736.7±3.0 cm3

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