ChemSpider 2D Image | beta-D-Galp-(1->3)-[alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)]-alpha-D-GalpNAc | C34H58N2O26

β-D-Galp-(1->3)-[α-D-Galp-(1->4)-β-D-Galp-(1->4)-β-D-GlcpNAc-(1->6)]-α-D-GalpNAc

  • Molecular FormulaC34H58N2O26
  • Average mass910.822 Da
  • Monoisotopic mass910.327759 Da
  • ChemSpider ID26332569

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

α-D-Galactopyranose, O-β-D-galactopyranosyl-(1->3)-O-[O-α-D-galactopyranosyl-(1->4)-O-β-D-galactopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->6)]-2-(acetylamino)-2- deoxy- [ACD/Index Name]
β-D-Galactopyranosyl-(1->3)-[α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->6)]-2-acetamido-2-deoxy-α-D-galactopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-[α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->6)]-2-acetamido-2-desoxy-α-D-galactopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-[α-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->6)]-2-acétamido-2-désoxy-α-D-galactopyranose [French] [ACD/IUPAC Name]
β-D-Galp-(1->3)-[α-D-Galp-(1->4)-β-D-Galp-(1->4)-β-D-GlcpNAc-(1->;6)]-α-D-GalpNAc
β-D-Gal-(1->3)-[α-D-Gal-(1->4)-β-D-Gal-(1->4)-β-D-GlcNAc-(1->6)]-α-D-GalNAc
β-D-Gal-(1->3)-[α-D-Gal-β-D-Gal-(1->4)-β-D-GlcNAc-(1->6)]-α-D-GalNAc
β-D-Galp-(1->3)-[α-D-Galp-β-D-Galp-(1->4)-β-D-GlcpNAc-(1->6)]-α-D-GalpNAc
  • Miscellaneous

    • Chemical Class:

      An amino pentasaccharide in which a galactose residue is linked <stereo>beta</stereo>(1<arrow>right</arrow>3) to the residue at the reducing end of a linear chain of two galactose residues, one <eleme nt>N</element>-acetylglucosamine residue and one <element>N</element>-acetylgalactosamine residue, sequentially linked <stereo>alpha</stereo>(1<arrow>right</arrow>4), <stereo>beta</stereo>(1<arrow>rig ht</arrow>4) and <stereo>beta</stereo>(1<arrow>right</arrow>6). ChEBI CHEBI:62187
      An amino pentasaccharide in which a galactose residue is linked beta(1right3) to the residue at the reducing end of a linear chain of two galactose residues, one N-acetylglucosamine residue and one N- acetylgalactosamine residue, sequentially linked alpha(1right4), beta(1right4) and beta(1right6). ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:62187

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1322.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 224.0±6.0 kJ/mol
Flash Point: 753.4±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: -7.62
ACD/LogD (pH 5.5): -7.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.93
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

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