ChemSpider 2D Image | 2-Acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranose | C34H58N2O26

2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose

  • Molecular FormulaC34H58N2O26
  • Average mass910.822 Da
  • Monoisotopic mass910.327759 Da
  • ChemSpider ID58163536

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Glucopyranose, O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]
[6)[GalNAc(β1-4)GlcNAc(β1-3)]Gal(β1-3)Gal(β1-4)Glc(β1-]n
[6)-[N-acetyl-β-D-galactosaminyl-(1->4)-N-acetyl-β-D-glucosaminyl-(1->3)]-β-D-galactosyl-(1->3)-β-D-galactosyl-(1->4)-β-D-glucosyl-(1->]n
[6)-[β-D-GalNAc-(1->4)-β-D-GlcNAc-(1->3)]-β-D-Gal-(1->3)-β-D-Gal-(1->4)-β-D-Glc-(1->]n
[6)-[β-D-GalpNAc-(1->4)-β-D-GlcpNAc-(1->3)]-β-D-Galp-(1->3)-β-D-Galp-(1->4)-β-D-Glcp-(1->]n
desialylated S. suis serotype 1 capsular polysaccharide
desialylated Streptococcus suis serotype 1 capsular polysaccharide
  • Miscellaneous

    • Chemical Class:

      A polysaccharide derivative with a repeating unit consisting of <stereo>beta</stereo>-<stereo>D</stereo>-galactosyl, <stereo>beta</stereo>-<stereo>D</stereo>-galactosyl and <stereo>beta</stereo>-<ster eo>D</stereo>-glucosyl residues linked sequentially (1<arrow>right</arrow>3) and (1<arrow>right</arrow>4), to the galactosyl residue at the non-reducing end of which is attached an <element>N</element >-acetyl-<stereo>beta</stereo>-<stereo>D</stereo>-galactosaminyl-(1<arrow>right</arrow>4)-<element>N</element>-acetyl-<stereo>beta</stereo>-<stereo>D</stereo>-glucosaminyl disaccharide unit via a (1<a rrow>right</arrow>3) linkage, with all repeating units being linked (1<arrow>right</arrow>6). Desialylated capsular polysaccharide of <ital>Streptococcus suis</ital> serotype 1. ChEBI CHEBI:132305

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1339.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 227.4±6.0 kJ/mol
Flash Point: 764.0±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 195.0±0.4 cm3
#H bond acceptors: 28
#H bond donors: 17
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -2.15
ACD/LogD (pH 5.5): -3.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 445 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 110.6±5.0 dyne/cm
Molar Volume: 523.9±5.0 cm3

Click to predict properties on the Chemicalize site


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