ChemSpider 2D Image | Man7GlcNAc-II | C50H85NO41

Man7GlcNAc-II

  • Molecular FormulaC50H85NO41
  • Average mass1356.192 Da
  • Monoisotopic mass1355.459717 Da
  • ChemSpider ID24606120

  • defined stereocentres - 40 of 40 defined stereocentres

More details:

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

Man7GlcNAc-II
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranose [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-α-D-mannopyranosyl-(1->6)]-β-D-mannopyra nosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Glucopyranose, O-α-D-mannopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->3)-O-[O-α-D-mannopyranosyl-(1->3)-O-[α-D-mannopyranosyl-(1->6)]-α-D-manno
 pyranosyl-(1->6)]-O-β-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]
Man-α-1-6(Man-α-1-3)Man-α-1-6(Man-α-1-2Man-α-1-2Man-α-1-3)Man-β-1-4GlcNAc

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

Density: 1.9±0.1 g/cm3
Boiling Point: 1628.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 286.4±6.0 kJ/mol
Flash Point: 938.7±34.3 °C
Index of Refraction: 1.704
Molar Refractivity: 284.6±0.4 cm3
#H bond acceptors: 42
#H bond donors: 26
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: -8.64
ACD/LogD (pH 5.5): -9.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 673 Å2
Polarizability: 112.8±0.5 10-24cm3
Surface Tension: 131.0±5.0 dyne/cm
Molar Volume: 733.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement