ChemSpider 2D Image | Methyl 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-6-thio-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranoside | C33H57NO25S

Methyl 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]-β-D-mannopyranoside

  • Molecular FormulaC33H57NO25S
  • Average mass899.862 Da
  • Monoisotopic mass899.294006 Da
  • ChemSpider ID25058873

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

2-Acétamido-2-désoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]-β-D-mannopyranoside de méthyle [French] [ACD/IUPAC Name]
methyl 2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]-β-D-mannopyranoside
Methyl 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]-β-D-mannopyranoside [ACD/IUPAC Name]
Methyl-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->2)-α-D-mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosid [German] [ACD/IUPAC Name]
β-D-Mannopyranoside, methyl O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->2)-O-α-D-mannopyranosyl-(1->3)-O-[O-α-D-mannopyranosyl-(1->6)-6-thio-α-D-mannopyranosyl-(1->6)]- [ACD/Index Name]
WZ4

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1250.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 210.2±6.0 kJ/mol
Flash Point: 709.8±34.3 °C
Index of Refraction: 1.676
Molar Refractivity: 194.6±0.4 cm3
#H bond acceptors: 26
#H bond donors: 16
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -2.68
ACD/LogD (pH 5.5): -3.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 441 Å2
Polarizability: 77.1±0.5 10-24cm3
Surface Tension: 110.5±5.0 dyne/cm
Molar Volume: 517.5±5.0 cm3

Click to predict properties on the Chemicalize site


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