ChemSpider 2D Image | beta-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-m annopyranosyl-(1->6)]-beta-D-mannopyranose | C46H78N2O36

β-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-m annopyranosyl-(1->6)]-β-D-mannopyranose

  • Molecular FormulaC46H78N2O36
  • Average mass1235.103 Da
  • Monoisotopic mass1234.433472 Da
  • ChemSpider ID4450551

  • defined stereocentres - 35 of 35 defined stereocentres

More details:

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

β-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->;2)-α-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-m annopyranosyl-(1->6)]-β-D-mannopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->2)-α-D -mannopyranosyl-(1->6)]-β-D-mannopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->2)-α-D -mannopyranosyl-(1->6)]-β-D-mannopyranose [French] [ACD/IUPAC Name]
β-D-Mannopyranose, O-β-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->3)-O-[O-β-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-de oxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->6)]- [ACD/Index Name]
GAL-(1-4)NAG-(1-2)MAN-(1-3)MAN-(6-1)MAN-(2-1)NAG-(4-1)GAL

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1552.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 270.3±6.0 kJ/mol
Flash Point: 892.5±34.3 °C
Index of Refraction: 1.687
Molar Refractivity: 262.4±0.4 cm3
#H bond acceptors: 38
#H bond donors: 23
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: -7.14
ACD/LogD (pH 5.5): -8.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 603 Å2
Polarizability: 104.0±0.5 10-24cm3
Surface Tension: 120.6±5.0 dyne/cm
Molar Volume: 689.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement