Found 1 result

Search term: 25054306 (Found by CSID)
ChemSpider 2D Image | L-alpha-Aspartyl-L-tyrosyl-L-methionine | C18H25N3O7S

L-α-Aspartyl-L-tyrosyl-L-methionine

  • Molecular FormulaC18H25N3O7S
  • Average mass427.472 Da
  • Monoisotopic mass427.141327 Da
  • ChemSpider ID25054306

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Methionine, L-α-aspartyl-L-tyrosyl- [ACD/Index Name]
L-α-Asparagyl-L-tyrosyl-L-methionin [German] [ACD/IUPAC Name]
L-α-Aspartyl-L-tyrosyl-L-methionine [ACD/IUPAC Name]
L-α-Aspartyl-L-tyrosyl-L-méthionine [French] [ACD/IUPAC Name]
(S)-3-amino-4-(((S)-1-(((S)-1-carboxy-3-(methylthio)propyl)amino)-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)amino)-4-oxobutanoic acid
121880-94-2 [RN]
L-Methionine, L-α-aspartyl-L-tyrosyl-

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 869.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 132.3±3.0 kJ/mol
    Flash Point: 479.4±34.3 °C
    Index of Refraction: 1.609
    Molar Refractivity: 105.8±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 7
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 1.10
    ACD/LogD (pH 5.5): -3.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 204 Å2
    Polarizability: 41.9±0.5 10-24cm3
    Surface Tension: 68.2±3.0 dyne/cm
    Molar Volume: 305.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement