ChemSpider 2D Image | ala-val-asp-his | C18H28N6O7

ala-val-asp-his

  • Molecular FormulaC18H28N6O7
  • Average mass440.451 Da
  • Monoisotopic mass440.201935 Da
  • ChemSpider ID28639286

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

ala-val-asp-his
L-Alanyl-L-valyl-L-α-asparagyl-L-histidin [German] [ACD/IUPAC Name]
L-Alanyl-L-valyl-L-α-aspartyl-L-histidine [ACD/IUPAC Name]
L-Alanyl-L-valyl-L-α-aspartyl-L-histidine [French] [ACD/IUPAC Name]
L-Histidine, L-alanyl-L-valyl-L-α-aspartyl- [ACD/Index Name]
AVDH
A-V-D-H
L-Ala-L-Val-L-Asp-L-His
  • Miscellaneous

    • Chemical Class:

      A tetrapeptide composed of <stereo>L</stereo>-alanine, <stereo>L</stereo>-valine, <stereo>L</stereo>-aspartic acid, and <stereo>L</stereo>-histidine joined in sequence by peptide linkages. ChEBI CHEBI:73383
      A tetrapeptide composed of L-alanine, L-valine, L-aspartic acid, and L-histidine joined in sequence by peptide linkages. ChEBI CHEBI:73383

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

Density: 1.4±0.1 g/cm3
Boiling Point: 948.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.7±3.0 kJ/mol
Flash Point: 527.7±34.3 °C
Index of Refraction: 1.574
Molar Refractivity: 105.9±0.3 cm3
#H bond acceptors: 13
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -0.80
ACD/LogD (pH 5.5): -3.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 217 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 321.0±3.0 cm3

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