ChemSpider 2D Image | PALMITOYL PENTAPEPTIDE-4 | C39H75N7O10

PALMITOYL PENTAPEPTIDE-4

  • Molecular FormulaC39H75N7O10
  • Average mass802.054 Da
  • Monoisotopic mass801.557556 Da
  • ChemSpider ID8072898

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-6-amino-2-hexadecanamidohexanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]hexanamido]-3-hydroxypropanoic acid
214047-00-4 [RN]
L-Serine, N2-(1-oxohexadecyl)-L-lysyl-L-threonyl-L-threonyl-L-lysyl- [ACD/Index Name]
N2-Palmitoyl-L-lysyl-L-threonyl-L-threonyl-L-lysyl-L-serin [German] [ACD/IUPAC Name]
N2-Palmitoyl-L-lysyl-L-threonyl-L-threonyl-L-lysyl-L-serine [ACD/IUPAC Name]
N2-Palmitoyl-L-lysyl-L-thréonyl-L-thréonyl-L-lysyl-L-sérine [French] [ACD/IUPAC Name]
PALMITOYL PENTAPEPTIDE-4
(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-1-oxo-2-(1-oxohexadecylamino)hexyl]amino]-3-hydroxy-1-oxobutyl]amino]-3-hydroxy-1-oxobutyl]amino]-1-oxohexyl]amino]-3-hydroxypropanoic acid(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-palmitamido-hexanoyl]amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-butanoyl]amino]hexanoyl]amino]-3-hydroxy-propionic acid
(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoic acid
(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-butanoyl]amino]hexanoyl]amino]-3-hydroxy-propanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

KK181SM5JG [DBID]
UNII:KK181SM5JG [DBID]
UNII-KK181SM5JG [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 1120.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 186.3±6.0 kJ/mol
    Flash Point: 631.2±34.3 °C
    Index of Refraction: 1.524
    Molar Refractivity: 213.8±0.3 cm3
    #H bond acceptors: 17
    #H bond donors: 13
    #Freely Rotating Bonds: 35
    #Rule of 5 Violations: 3
    ACD/LogP: 3.72
    ACD/LogD (pH 5.5): -0.79
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.79
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 296 Å2
    Polarizability: 84.8±0.5 10-24cm3
    Surface Tension: 50.2±3.0 dyne/cm
    Molar Volume: 699.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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