ChemSpider 2D Image | Gliadophorin | C43H57N9O11

Gliadophorin

  • Molecular FormulaC43H57N9O11
  • Average mass875.966 Da
  • Monoisotopic mass875.417725 Da
  • ChemSpider ID115783

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

Gliadophorin [Wiki]
Gliadorphin
Gliadorphin-7
L-Phenylalanine, L-tyrosyl-L-prolyl-L-glutaminyl-L-prolyl-L-glutaminyl-L-prolyl- [ACD/Index Name]
L-Tyrosyl-L-prolyl-L-glutaminyl-L-prolyl-L-glutaminyl-L-prolyl-L-phenylalanin [German] [ACD/IUPAC Name]
L-Tyrosyl-L-prolyl-L-glutaminyl-L-prolyl-L-glutaminyl-L-prolyl-L-phenylalanine [ACD/IUPAC Name]
L-Tyrosyl-L-prolyl-L-glutaminyl-L-prolyl-L-glutaminyl-L-prolyl-L-phénylalanine [French] [ACD/IUPAC Name]
α-Gliadin (43-49)
(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid
(2S)-2-{[(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-AMINO-3-(4-HYDROXYPHENYL)PROPANOYL]PYRROLIDIN-2-YL]FORMAMIDO}-4-CARBAMOYLBUTANOYL]PYRROLIDIN-2-YL]FORMAMIDO}-4-CARBAMOYLBUTANOYL]PYRROLIDIN-2-YL]FORMAMIDO}-3-PHENYLPROPANOIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 1356.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 214.6±3.0 kJ/mol
    Flash Point: 773.9±34.3 °C
    Index of Refraction: 1.623
    Molar Refractivity: 223.3±0.3 cm3
    #H bond acceptors: 20
    #H bond donors: 11
    #Freely Rotating Bonds: 20
    #Rule of 5 Violations: 3
    ACD/LogP: -0.43
    ACD/LogD (pH 5.5): -3.32
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.38
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 318 Å2
    Polarizability: 88.5±0.5 10-24cm3
    Surface Tension: 72.8±3.0 dyne/cm
    Molar Volume: 633.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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