ChemSpider 2D Image | Glycyl-L-seryl-L-alpha-aspartyl-L-histidine | C15H22N6O8

Glycyl-L-seryl-L-α-aspartyl-L-histidine

  • Molecular FormulaC15H22N6O8
  • Average mass414.371 Da
  • Monoisotopic mass414.149902 Da
  • ChemSpider ID57488756

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

Glycyl-L-seryl-L-α-asparagyl-L-histidin [German] [ACD/IUPAC Name]
Glycyl-L-seryl-L-α-aspartyl-L-histidine [ACD/IUPAC Name]
Glycyl-L-séryl-L-α-aspartyl-L-histidine [French] [ACD/IUPAC Name]
L-Histidine, glycyl-L-seryl-L-α-aspartyl- [ACD/Index Name]
(3S)-3-[(2S)-2-(2-AMINOACETAMIDO)-3-HYDROXYPROPANAMIDO]-3-{[(1S)-1-CARBOXY-2-(3H-IMIDAZOL-4-YL)ETHYL]CARBAMOYL}PROPANOIC ACID

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

Density: 1.5±0.1 g/cm3
Boiling Point: 1078.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 165.7±3.0 kJ/mol
Flash Point: 606.0±34.3 °C
Index of Refraction: 1.615
Molar Refractivity: 93.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 9
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -2.61
ACD/LogD (pH 5.5): -5.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 237 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 85.7±3.0 dyne/cm
Molar Volume: 268.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement