ChemSpider 2D Image | D-gamma-Glutamyl-S-[(4R,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxy-6,8,10,13-nonadecatetraen-5-yl]cysteine | C28H44N2O8S

D-γ-Glutamyl-S-[(4R,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxy-6,8,10,13-nonadecatetraen-5-yl]cysteine

  • Molecular FormulaC28H44N2O8S
  • Average mass568.723 Da
  • Monoisotopic mass568.281860 Da
  • ChemSpider ID74857894

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 4 defined stereocentres

More details:

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

Cysteine, D-γ-glutamyl-S-[(1R,2E,4E,6Z,9Z)-1-[(1R)-4-carboxy-1-hydroxybutyl]-2,4,6,9-pentadecatetraen-1-yl]- [ACD/Index Name]
D-γ-Glutamyl-S-[(4R,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxy-6,8,10,13-nonadecatetraen-5-yl]cystein [German] [ACD/IUPAC Name]
D-γ-Glutamyl-S-[(4R,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxy-6,8,10,13-nonadecatetraen-5-yl]cysteine [ACD/IUPAC Name]
D-γ-Glutamyl-S-[(4R,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxy-6,8,10,13-nonadécatétraén-5-yl]cystéine [French] [ACD/IUPAC Name]
leukotriene-f4

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: 1.2±0.1 g/cm3
Boiling Point: 872.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 144.1±6.0 kJ/mol
Flash Point: 481.6±34.3 °C
Index of Refraction: 1.563
Molar Refractivity: 153.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: 4.54
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 213 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 471.7±3.0 cm3

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