ChemSpider 2D Image | beta-D-Galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose | C32H55NO26

β-D-Galactopyranosyl-(1->3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1->3)-α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-D-glucopyranose

  • Molecular FormulaC32H55NO26
  • Average mass869.770 Da
  • Monoisotopic mass869.301208 Da
  • ChemSpider ID76963337

  • defined stereocentres - 24 of 25 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-galactopyranosyl-(1->3)-O-α-D-galactopyranosyl-(1->4)-O-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1->3)-α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-desoxy-β-D-galactopyranosyl-(1->3)-α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acétamido-2-désoxy-β-D-galactopyranosyl-(1->3)-α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-D-glucopyranose [French] [ACD/IUPAC Name]
Galb1-3GalNAcb1-3Gala1-4Galb1-4Glc
Galbeta1,3GalNAcbeta1,3Galalpha1,4Galbeta1,4Glc
Galpbeta1-3GalpNAcbeta1-3Galpalpha1-4Galpbeta1-4Glcp
missing
WURCS=2.0/4,5,4/[a2122h-1x1-5][a2112h-1b1-5][a2112h-1a1-5][a2112h-1b1-52*NCC/3=O]/1-2-3-4-2/a4-b1b4-c1c3-d1d3-e1
β-D-Gal-(1->3)-β-D-GalNAc-(1->3)-α-D-Gal-(1->4)-β-D-Gal-(1->4)-D-Glc
More...
  • Miscellaneous

    • Chemical Class:

      A linear amino pentasaccharide comprising D-glucose at the reducing end with a beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl moiety at the 4- position. ChEBI CHEBI:141842
      A linear amino pentasaccharide comprising D-glucose at the reducing end with a beta-D-galactosyl-(1right3)-N-acetyl; -beta-D-glucosaminyl-(1right3)-alpha-D-galactosyl-(1right4)-beta-D-g; alactosyl moi ety at the 4-position. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:141842

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1252.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 210.8±6.0 kJ/mol
Flash Point: 711.6±34.3 °C
Index of Refraction: 1.681
Molar Refractivity: 183.5±0.4 cm3
#H bond acceptors: 27
#H bond donors: 17
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -6.42
ACD/LogD (pH 5.5): -7.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 436 Å2
Polarizability: 72.7±0.5 10-24cm3
Surface Tension: 119.1±5.0 dyne/cm
Molar Volume: 485.1±5.0 cm3

Click to predict properties on the Chemicalize site


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