ChemSpider 2D Image | Fibronectin CS-1 Fragment (1978-1985) | C38H64N8O15

Fibronectin CS-1 Fragment (1978-1985)

  • Molecular FormulaC38H64N8O15
  • Average mass872.959 Da
  • Monoisotopic mass872.449097 Da
  • ChemSpider ID8094792

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

136466-51-8 [RN]
Fibronectin CS-1 Fragment (1978-1985)
L-Threonine, L-α-glutamyl-L-isoleucyl-L-leucyl-L-α-aspartyl-L-valyl-L-prolyl-L-seryl- [ACD/Index Name]
L-α-Glutamyl-L-isoleucyl-L-leucyl-L-α-asparagyl-L-valyl-L-prolyl-L-seryl-L-threonin [German] [ACD/IUPAC Name]
L-α-Glutamyl-L-isoleucyl-L-leucyl-L-α-aspartyl-L-valyl-L-prolyl-L-seryl-L-threonine [ACD/IUPAC Name]
L-α-Glutamyl-L-isoleucyl-L-leucyl-L-α-aspartyl-L-valyl-L-prolyl-L-séryl-L-thréonine [French] [ACD/IUPAC Name]
(4S)-4-AMINO-4-{[(1S,2S)-1-{[(1S)-1-{[(1S)-2-CARBOXY-1-{[(2S)-1-[(2S)-2-{[(1S)-1-{[(1S,2R)-1-CARBOXY-2-HYDROXYPROPYL]CARBAMOYL}-2-HYDROXYETHYL]CARBAMOYL}PYRROLIDIN-1-YL]-3-METHYL-1-OXOBUTAN-2-YL]CARBAMOYL}ETHYL]CARBAMOYL}-3-METHYLBUTYL]CARBAMOYL}-2-METHYLBUTYL]CARBAMOYL}BUTANOIC ACID
(4S)-4-amino-5-[[(2S,3S)-1-[[(2S)-1-[[(2S)-3-carboxy-1-[[(2S)-1-[(2S)-2-[[(2S)-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-3-hydroxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid
Fibronectin CS-1 Peptide
FIBRONECTIN CS1 PEPTIDE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 1306.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 220.9±6.0 kJ/mol
    Flash Point: 743.6±34.3 °C
    Index of Refraction: 1.553
    Molar Refractivity: 212.0±0.3 cm3
    #H bond acceptors: 23
    #H bond donors: 13
    #Freely Rotating Bonds: 26
    #Rule of 5 Violations: 3
    ACD/LogP: 1.10
    ACD/LogD (pH 5.5): -4.93
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 373 Å2
    Polarizability: 84.0±0.5 10-24cm3
    Surface Tension: 62.2±3.0 dyne/cm
    Molar Volume: 662.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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