ChemSpider 2D Image | 6-Deoxy-alpha-L-galactopyranosyl-(1->6)-[beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-beta-D-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deox y-beta-D-glucopyranosyl-(1->2)-beta-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-glucose | C68H114N4O50

6-Deoxy-α-L-galactopyranosyl-(1->6)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deox y-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-glucose

  • Molecular FormulaC68H114N4O50
  • Average mass1787.630 Da
  • Monoisotopic mass1786.650024 Da
  • ChemSpider ID62846412

  • defined stereocentres - 49 of 49 defined stereocentres

More details:

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

6-Deoxy-α-L-galactopyranosyl-(1->6)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-deox y-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-glucose [ACD/IUPAC Name]
6-Desoxy-α-L-galactopyranosyl-(1->6)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acetamido-2-de soxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)]-2-acetamido-2-desoxy-D-glucose [German] [ACD/IUPAC Name]
6-Désoxy-α-L-galactopyranosyl-(1->6)-[β-D-galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->3)-[β-D-galactopyranosyl-(1->4)-2-acétamido-2-dé soxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)]-2-acétamido-2-désoxy-D-glucose [French] [ACD/IUPAC Name]
D-Glucose, O-6-deoxy-α-L-galactopyranosyl-(1->6)-O-[O-β-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->2)-O-β-D-mannopyranosyl-(1->3)-O-[O-β-D-galactopyrano syl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->2)-β-D-mannopyranosyl-(1->6)]-O-β-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)]-2-(acetylamino)-2-d ;eoxy- [ACD/Index Name]
142561-43-1 [RN]
MANNOTRIOSE-(FUCOSYL-DI-(N-ACETYL-D-*GLUCOSAMINE))-B

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.677
Molar Refractivity: 385.7±0.4 cm3
#H bond acceptors: 54
#H bond donors: 31
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 3
ACD/LogP: -7.43
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 846 Å2
Polarizability: 152.9±0.5 10-24cm3
Surface Tension: 115.3±5.0 dyne/cm
Molar Volume: 1024.6±5.0 cm3

Click to predict properties on the Chemicalize site


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