Found 1 result

Search term: YBWKZHLDBNHVSC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Adamantan-1-yl L-tyrosyl-D-alanylglycyl-L-phenylalanyl-L-leucinate | C39H53N5O7

Adamantan-1-yl L-tyrosyl-D-alanylglycyl-L-phenylalanyl-L-leucinate

  • Molecular FormulaC39H53N5O7
  • Average mass703.867 Da
  • Monoisotopic mass703.394470 Da
  • ChemSpider ID8208261

  • defined stereocentres - 4 of 8 defined stereocentres

More details:

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

Adamantan-1-yl L-tyrosyl-D-alanylglycyl-L-phenylalanyl-L-leucinate [ACD/IUPAC Name]
Adamantan-1-yl-L-tyrosyl-D-alanylglycyl-L-phenylalanyl-L-leucinat [German] [ACD/IUPAC Name]
L-Leucine, L-tyrosyl-D-alanylglycyl-L-phenylalanyl-, tricyclo[3.3.1.13,7]dec-1-yl ester [ACD/Index Name]
L-Tyrosyl-D-alanylglycyl-L-phénylalanyl-L-leucinate d'adamantan-1-yle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 990.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 149.3±3.0 kJ/mol
Flash Point: 552.5±34.3 °C
Index of Refraction: 1.608
Molar Refractivity: 192.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 4
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 8.51
ACD/KOC (pH 5.5): 52.20
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 266.77
ACD/KOC (pH 7.4): 1635.68
Polar Surface Area: 189 Å2
Polarizability: 76.2±0.5 10-24cm3
Surface Tension: 61.2±5.0 dyne/cm
Molar Volume: 556.0±5.0 cm3

Click to predict properties on the Chemicalize site


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