ChemSpider 2D Image | N~6~-[(3alpha,5beta)-3-Hydroxy-24-oxocholan-24-yl]-L-lysine | C30H52N2O4

N6-[(3α,5β)-3-Hydroxy-24-oxocholan-24-yl]-L-lysine

  • Molecular FormulaC30H52N2O4
  • Average mass504.745 Da
  • Monoisotopic mass504.392700 Da
  • ChemSpider ID111435

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

L-Lysine, N6-[(3α,5β)-3-hydroxy-24-oxocholan-24-yl]- [ACD/Index Name]
N6-[(3α,5β)-3-Hydroxy-24-oxocholan-24-yl]-L-lysin [German] [ACD/IUPAC Name]
N6-[(3α,5β)-3-Hydroxy-24-oxocholan-24-yl]-L-lysine [ACD/IUPAC Name]
N6-[(3α,5β)-3-Hydroxy-24-oxocholan-24-yl]-L-lysine [French] [ACD/IUPAC Name]
65236-49-9 [RN]
Lithocholyl-ε-L-lysine
L-Lysine, N6-((3α,5β)-3-hydroxy-24-oxocholan-24-yl)-
N-ε-Lithocholyllysine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 685.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±6.0 kJ/mol
Flash Point: 368.5±30.1 °C
Index of Refraction: 1.534
Molar Refractivity: 143.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.57
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 2.46
ACD/KOC (pH 5.5): 12.93
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 2.46
ACD/KOC (pH 7.4): 12.88
Polar Surface Area: 113 Å2
Polarizability: 56.7±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 459.9±3.0 cm3

Click to predict properties on the Chemicalize site


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