Found 1 result

Search term: MF = 'C_{56}H_{98}N_{14}O_{14}'

ChemSpider 2D Image | L-Alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-alpha-aspartyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl-L-prolinamide | C56H98N14O14

L-Alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-α-aspartyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl-L-prolinamide

  • Molecular FormulaC56H98N14O14
  • Average mass1191.463 Da
  • Monoisotopic mass1190.738647 Da
  • ChemSpider ID76795071
  • defined stereocentres - 12 of 12 defined stereocentres


More details:






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

L-Alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-α-asparagyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl-L-prolinamid [German] [ACD/IUPAC Name]
L-Alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-α-aspartyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl-L-prolinamide [ACD/IUPAC Name]
L-Alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-α-aspartyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl-L-prolinamide [French] [ACD/IUPAC Name]
L-Prolinamide, L-alanyl-L-alanyl-L-lysyl-L-leucyl-L-leucyl-L-prolyl-L-α-aspartyl-L-leucyl-L-leucyl-L-alanyl-L-alanyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 1492.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 247.9±6.0 kJ/mol
Flash Point: 856.4±34.3 °C
Index of Refraction: 1.539
Molar Refractivity: 308.3±0.3 cm3
#H bond acceptors: 28
#H bond donors: 16
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 3
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -3.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 435 Å2
Polarizability: 122.2±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 983.5±3.0 cm3

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