ChemSpider 2D Image | N-Acetyl-D-seryl-L-alpha-aspartyl-D-lysyl-D-proline | C20H33N5O9

N-Acetyl-D-seryl-L-α-aspartyl-D-lysyl-D-proline

  • Molecular FormulaC20H33N5O9
  • Average mass487.504 Da
  • Monoisotopic mass487.227814 Da
  • ChemSpider ID103835828

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R)-1-[(2R)-6-amino-2-[(2S)-3-carboxy-2-[(2R)-2-acetamido-3-hydroxypropanamido]propanamido]hexanoyl]pyrrolidine-2-carboxylic acid
127103-11-1 [RN]
D-Proline, N-acetyl-D-seryl-L-α-aspartyl-D-lysyl- [ACD/Index Name]
N-Acetyl-D-seryl-L-α-asparagyl-D-lysyl-D-prolin [German] [ACD/IUPAC Name]
N-Acetyl-D-seryl-L-α-aspartyl-D-lysyl-D-proline [ACD/IUPAC Name]
N-Acétyl-D-séryl-L-α-aspartyl-D-lysyl-D-proline [French] [ACD/IUPAC Name]
(2R)-1-[(2R)-2-[[(2S)-2-[[(2R)-2-acetamido-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-aminohexanoyl]pyrrolidine-2-carboxylic acid
Ac-D-Ser-Asp-D-Lys-D-Pro-OH
N-acetyl-Ser-Asp-Lys-Pro

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

Density: 1.4±0.1 g/cm3
Boiling Point: 992.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 163.9±6.0 kJ/mol
Flash Point: 553.7±34.3 °C
Index of Refraction: 1.565
Molar Refractivity: 114.9±0.3 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: -1.91
ACD/LogD (pH 5.5): -5.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 228 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 69.1±3.0 dyne/cm
Molar Volume: 352.6±3.0 cm3

Click to predict properties on the Chemicalize site


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