ChemSpider 2D Image | beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp | C26H45NO21

β-D-Galp-(1->3)-β-D-GlcpNAc-(1->4)-β-D-Galp-(1->4)-β-D-Glcp

  • Molecular FormulaC26H45NO21
  • Average mass707.630 Da
  • Monoisotopic mass707.248413 Da
  • ChemSpider ID8344545

  • defined stereocentres - 20 of 20 defined stereocentres

More details:

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

β-D-Galactopyranosyl-(1->3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-desoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Galp-(1->3)-β-D-GlcpNAc-(1->4)-β-D-Galp-(1->4)-β-D-Glcp
β-D-Glucopyranose, O-β-D-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]
Galb1-3GalNAcb1-4Galb1-4Glcb
Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta
missing
O-(β-D-galactopyranosyl)-(1->3)-O-(2-acetamido-2-desoxy-β-D-galactopyranosyl)-(1->4)-O-(β-D-galactopyranosyl)-(1->4)-β-D-glucopyranose
O-β-D-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5721191 [DBID]
  • Miscellaneous

    • Chemical Class:

      An amino tetrasaccharide consisting of <stereo>beta</stereo>-<stereo>D</stereo>-galactose, <element>N</element>-acetyl-<stereo>beta</stereo>-<stereo>D</stereo>-galactosamine, <stereo>beta</stereo>-<st ereo>D</stereo>-galactose and <stereo>beta</stereo>-<stereo>D</stereo>-glucose residues in a linear (1<arrow>right</arrow>3), (1<arrow>right</arrow>4), (1<arrow>right</arrow>4) sequence. ChEBI CHEBI:59216
      An amino tetrasaccharide consisting of beta-D-galactose, N-acetyl-beta-D-galactosamine, beta-D-galactose and beta-D-glucose residues in a linear (1->3), (1->4), (1->4) sequence. It is the carbohydrate portion of ganglioside GA1. ChEBI CHEBI:59216
      An amino tetrasaccharide consisting of beta-D-galactose, N-acetyl-beta-D-galactosamine, beta-D-galactose and beta-D-glucose residues in a linear (1right3), (1right4), (1right4) sequence. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:59216

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1100.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 182.8±6.0 kJ/mol
Flash Point: 619.2±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: -6.27
ACD/LogD (pH 5.5): -6.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.60
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

Click to predict properties on the Chemicalize site


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