ChemSpider 2D Image | beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->3)-D-Glc | C26H45NO21

β-D-Gal-(1->3)-β-D-GlcNAc-(1->3)-β-D-Gal-(1->3)-D-Glc

  • Molecular FormulaC26H45NO21
  • Average mass707.630 Da
  • Monoisotopic mass707.248413 Da
  • ChemSpider ID26331844

  • defined stereocentres - 19 of 20 defined stereocentres

More details:

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

D-Glucopyranose, O-β-D-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->3)- [ACD/Index Name]
β-D-Gal-(1->3)-β-D-GlcNAc-(1->3)-β-D-Gal-(1->3)-D-Glc
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->;3)-β-D-galactopyranosyl-(1->3)-D-glucopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-D-glucopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->3)-D-glucopyranose [French] [ACD/IUPAC Name]
Galbeta1-3GlcNAcbeta1-3Galbeta1-3Glc
missing
β-D-galactosyl-(1->3)-β-D-N-acetylglucosaminyl-(1->3)-β-D-galactosyl-(1->3)-D-glucose
β-D-Galp-(1->3)-β-D-GlcpNAc-(1->3)-β-D-Galp-(1->3)-D-Glcp
β-Gal1,3-β-GlcNAc1,3-β-Gal1,3-Glc
  • Miscellaneous

    • Chemical Class:

      An amino tetrasaccharide comprising residues of galactose, <element>N</element>-acetylglucosamine, galactose and glucose in a linear sequence, all joined by <stereo>beta</stereo>-(1<arrow>right</arrow >3)-linkages. ChEBI CHEBI:60220
      An amino tetrasaccharide comprising residues of galactose, N-acetylglucosamine, galactose and glucose in a linear sequence, all joined by beta-(1->3)-linkages. ChEBI CHEBI:60220
      An amino tetrasaccharide comprising residues of galactose, N-acetylglucosamine, galactose and glucose in a linear sequence, all joined by beta-(1right3)-linkages. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:60220

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1132.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 188.5±6.0 kJ/mol
Flash Point: 638.5±34.3 °C
Index of Refraction: 1.668
Molar Refractivity: 149.7±0.4 cm3
#H bond acceptors: 22
#H bond donors: 14
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -6.65
ACD/LogD (pH 5.5): -6.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 357 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 113.0±5.0 dyne/cm
Molar Volume: 401.8±5.0 cm3

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