ChemSpider 2D Image | N~6~-[(5beta)-3,24-Dioxocholan-24-yl]-L-lysine | C30H50N2O4

N6-[(5β)-3,24-Dioxocholan-24-yl]-L-lysine

  • Molecular FormulaC30H50N2O4
  • Average mass502.729 Da
  • Monoisotopic mass502.377045 Da
  • ChemSpider ID571240

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2S)-2-AMINO-6-({(4R)-4-[(10R,13S)-10,13-DIMETHYL-3-OXOHEXADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL]PENTANOYL}AMINO)HEXANOIC ACID
L-Lysine, N6-[(5β)-3,24-dioxocholan-24-yl]- [ACD/Index Name]
N6-[(5β)-3,24-Dioxocholan-24-yl]-L-lysin [German] [ACD/IUPAC Name]
N6-[(5β)-3,24-Dioxocholan-24-yl]-L-lysine [ACD/IUPAC Name]
N6-[(5β)-3,24-Dioxocholan-24-yl]-L-lysine [French] [ACD/IUPAC Name]
UZ9

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

Density: 1.1±0.1 g/cm3
Boiling Point: 684.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 109.5±6.0 kJ/mol
Flash Point: 367.9±30.1 °C
Index of Refraction: 1.528
Molar Refractivity: 141.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 2.00
ACD/KOC (pH 5.5): 11.13
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 1.99
ACD/KOC (pH 7.4): 11.09
Polar Surface Area: 109 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 459.4±3.0 cm3

Click to predict properties on the Chemicalize site


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