Found 23 results

Search term: MF = 'C_{46}H_{81}O_{10}P'
ChemSpider 2D Image | (9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26lambda~5~-phosphatriacont-9-en-23-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate | C46H81O10P

(9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriacont-9-en-23-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate

  • Molecular FormulaC46H81O10P
  • Average mass825.103 Da
  • Monoisotopic mass824.556763 Da
  • ChemSpider ID113377254

  • 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

(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatétraénoate de (9Z,23R,29S)-26,29,30-trihydroxy-20-oxo-26-oxydo-21,25,27-trioxa-26λ5-phosphatriacont-9-én-23-yle [French] [ACD/IUPAC Name]
(9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriacont-9-en-23-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
(9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriacont-9-en-23-yl-(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
5,8,11,14-Eicosatetraenoic acid, (1R)-2-[[[(2S)-2,3-dihydroxypropoxy]hydroxyphosphinyl]oxy]-1-[[[(11Z)-1-oxo-11-eicosen-1-yl]oxy]methyl]ethyl ester, (5Z,8Z,11Z,14Z)- [ACD/Index Name]
1-(11Z-eicosenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-glycero-3-phospho-(1'-sn-glycerol)
PG(20:1(11Z)/20:4(5Z,8Z,11Z,14Z))
PG(20:1_20:4)
PG(40:5)

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

Density: 1.0±0.1 g/cm3
Boiling Point: 828.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 137.0±6.0 kJ/mol
Flash Point: 454.9±37.1 °C
Index of Refraction: 1.502
Molar Refractivity: 233.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 3
ACD/LogP: 14.49
ACD/LogD (pH 5.5): 8.16
ACD/BCF (pH 5.5): 140068.77
ACD/KOC (pH 5.5): 17846.34
ACD/LogD (pH 7.4): 8.08
ACD/BCF (pH 7.4): 118470.78
ACD/KOC (pH 7.4): 15094.52
Polar Surface Area: 159 Å2
Polarizability: 92.7±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 793.0±3.0 cm3

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