Found 23 results

Search term: MF = 'C_{46}H_{81}O_{10}P'
ChemSpider 2D Image | (6Z,9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26lambda~5~-phosphatriaconta-6,9-dien-23-yl (8Z,11Z,14Z)-8,11,14-icosatrienoate | C46H81O10P

(6Z,9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriaconta-6,9-dien-23-yl (8Z,11Z,14Z)-8,11,14-icosatrienoate

  • Molecular FormulaC46H81O10P
  • Average mass825.103 Da
  • Monoisotopic mass824.556763 Da
  • ChemSpider ID113377283

  • 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

(6Z,9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriaconta-6,9-dien-23-yl (8Z,11Z,14Z)-8,11,14-icosatrienoate [ACD/IUPAC Name]
(6Z,9Z,23R,29S)-26,29,30-Trihydroxy-26-oxido-20-oxo-21,25,27-trioxa-26λ5-phosphatriaconta-6,9-dien-23-yl-(8Z,11Z,14Z)-8,11,14-icosatrienoat [German] [ACD/IUPAC Name]
(8Z,11Z,14Z)-8,11,14-Icosatriénoate de (6Z,9Z,23R,29S)-26,29,30-trihydroxy-20-oxo-26-oxydo-21,25,27-trioxa-26λ5-phosphatriaconta-6,9-dién-23-yle [French] [ACD/IUPAC Name]
8,11,14-Eicosatrienoic acid, (1R)-2-[[[(2S)-2,3-dihydroxypropoxy]hydroxyphosphinyl]oxy]-1-[[[(11Z,14Z)-1-oxo-11,14-eicosadien-1-yl]oxy]methyl]ethyl ester, (8Z,11Z,14Z)- [ACD/Index Name]
1-(11Z,14Z-eicosadienoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-glycero-3-phospho-(1'-sn-glycerol)
PG(20:2(11Z,14Z)/20:3(8Z,11Z,14Z))
PG(20:2_20:3)
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: 14.53
ACD/LogD (pH 5.5): 7.84
ACD/BCF (pH 5.5): 80444.45
ACD/KOC (pH 5.5): 11999.54
ACD/LogD (pH 7.4): 7.77
ACD/BCF (pH 7.4): 68035.20
ACD/KOC (pH 7.4): 10148.50
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

Click to predict properties on the Chemicalize site


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