ChemSpider 2D Image | N-Acetyl-2-methylalanyl-L-prolyl-2-methylalanyl-D-alanyl-2-methylalanyl-D-alanyl-L-glutaminyl-2-methylalanyl-L-valyl-2-methylalanylglycyl-L-leucyl-2-methylalanyl-L-prolyl-L-valyl-2-methylalanyl-2-meth ylalanyl-L-alpha-glutamyl-N~1~-[(2R)-1-hydroxy-3-phenyl-2-propanyl]-L-glutamamide | C92H150N22O25

N-Acetyl-2-methylalanyl-L-prolyl-2-methylalanyl-D-alanyl-2-methylalanyl-D-alanyl-L-glutaminyl-2-methylalanyl-L-valyl-2-methylalanylglycyl-L-leucyl-2-methylalanyl-L-prolyl-L-valyl-2-methylalanyl-2-meth ylalanyl-L-α-glutamyl-N1-[(2R)-1-hydroxy-3-phenyl-2-propanyl]-L-glutamamide

  • Molecular FormulaC92H150N22O25
  • Average mass1964.308 Da
  • Monoisotopic mass1963.114258 Da
  • ChemSpider ID107442391

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

L-Glutamamide, N-acetyl-2-methylalanyl-L-prolyl-2-methylalanyl-D-alanyl-2-methylalanyl-D-alanyl-L-glutaminyl-2-methylalanyl-L-valyl-2-methylalanylglycyl-L-leucyl-2-methylalanyl-L-prolyl-L-valyl-2-meth ;ylalanyl-2-methylalanyl-L-α-glutamyl-N1-[(1R)-2-hydroxy-1-(phenylmethyl)ethyl]- [ACD/Index Name]
N-Acetyl-2-methylalanyl-L-prolyl-2-methylalanyl-D-alanyl-2-methylalanyl-D-alanyl-L-glutaminyl-2-methylalanyl-L-valyl-2-methylalanylglycyl-L-leucyl-2-methylalanyl-L-prolyl-L-valyl-2-methylalanyl-2-meth ;ylalanyl-L-α-glutamyl-N1-[(2R)-1-hydroxy-3-phenyl-2-propanyl]-L-glutamamid [German] [ACD/IUPAC Name]
N-Acetyl-2-methylalanyl-L-prolyl-2-methylalanyl-D-alanyl-2-methylalanyl-D-alanyl-L-glutaminyl-2-methylalanyl-L-valyl-2-methylalanylglycyl-L-leucyl-2-methylalanyl-L-prolyl-L-valyl-2-methylalanyl-2-meth ;ylalanyl-L-α-glutamyl-N1-[(2R)-1-hydroxy-3-phenyl-2-propanyl]-L-glutamamide [ACD/IUPAC Name]
N-Acétyl-2-méthylalanyl-L-prolyl-2-méthylalanyl-D-alanyl-2-méthylalanyl-D-alanyl-L-glutaminyl-2-méthylalanyl-L-valyl-2-méthylalanylglycyl-L-leucyl-2-méthylalanyl-L-prolyl-L-valyl-2-méthylalanyl-2-méth ;ylalanyl-L-α-glutamyl-N1-[(2R)-1-hydroxy-3-phényl-2-propanyl]-L-glutamamide [French] [ACD/IUPAC Name]
27061-78-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 2090.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 369.7±3.0 kJ/mol
Flash Point: 1217.8±34.3 °C
Index of Refraction: 1.547
Molar Refractivity: 502.2±0.3 cm3
#H bond acceptors: 47
#H bond donors: 24
#Freely Rotating Bonds: 53
#Rule of 5 Violations: 3
ACD/LogP: -0.07
ACD/LogD (pH 5.5): -3.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 708 Å2
Polarizability: 199.1±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 1583.4±3.0 cm3

Click to predict properties on the Chemicalize site


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