ChemSpider 2D Image | alpha-L-Fuc-(1->3)-[beta-D-Xyl-(1->2)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)]-D-GlcNAc | C33H56N2O24

α-L-Fuc-(1->3)-[β-D-Xyl-(1->2)-β-D-Man-(1->4)-β-D-GlcNAc-(1->4)]-D-GlcNAc

  • Molecular FormulaC33H56N2O24
  • Average mass864.797 Da
  • Monoisotopic mass864.322327 Da
  • ChemSpider ID23107151

  • defined stereocentres - 23 of 24 defined stereocentres

More details:

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

6-Deoxy-α-L-galactopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->2)-β-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-glucopyranose [ACD/IUPAC Name]
6-Desoxy-α-L-galactopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->2)-β-D-mannopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)]-2-acetamido-2-desoxy-D-glucopyranose [German] [ACD/IUPAC Name]
6-Désoxy-α-L-galactopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->2)-β-D-mannopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)]-2-acétamido-2-désoxy-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, O-6-deoxy-α-L-galactopyranosyl-(1->3)-O-[O-β-D-xylopyranosyl-(1->2)-O-β-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->;4)]-2-(acetylamino)-2-deoxy - [ACD/Index Name]
α-L-Fuc-(1->3)-[β-D-Xyl-(1->2)-β-D-Man-(1->4)-β-D-GlcNAc-(1->4)]-D-GlcNAc
00XF(3)
6-deoxy-α-L-galactopyranosyl-(1->3)-[β-D-xylopyranosyl-(1->2)-β-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)]-2-(acetylamino)-2-deoxy-D-glucopyranose
D-glucopyranose, O-6-deoxy-α-L-galactopyranosyl-(1->3)-O-[O-β-D-xylopyranosyl-(1->2)-O-β-D-mannopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->;4)]-2-(acetylamino)-2-deoxy-
missing
WURCS=2.0/5,5,4/[a2122h-1x1-52*NCC/3=O][a1221m-1a1-5][a2122h-1b1-52*NCC/3=O][a1122h-1b1-5][a212h-1b1-5]/1-2-3-4-5/a3-b1a4-c1c4-d1d2-e1
More...
  • Miscellaneous

    • Chemical Class:

      A branched pentasaccharide consisting of an <stereo>D</stereo>-GlcNAc residue at the reducing end with a <stereo>beta</stereo>-<stereo>D</stereo>-Xyl(1<arrow>right</arrow>2)-<stereo>beta</stereo>-<ste reo>D</stereo>-Man(1<arrow>right</arrow>4)-<stereo>beta</stereo>-<stereo>D</stereo>-GlcNAc moiety attached via a <stereo>beta</stereo>-(1<arrow>right</arrow>4)-linkage and a <stereo>D</stereo>-Fuc res idue attached via an <stereo>alpha</stereo>-(1<arrow>right</arrow>3)-linkage. ChEBI CHEBI:53456
      A branched pentasaccharide consisting of an D-GlcNAc residue at the reducing end with a beta-D-Xyl(1->2)-beta-D-Man(1->4)-beta-D-GlcNAc moiety attached via a beta-(1->4)-linkage and a D-Fuc residue at tached via an alpha-(1->3)-linkage. ChEBI CHEBI:53456
      A branched pentasaccharide consisting of an D-GlcNAc residue at the reducing end with a beta-D-Xyl(1right2)-beta-D-Man(1right4)-beta-D-GlcNAc moiety attached via a beta-(1right4)-linkage and a D-Fuc r esidue attached via an alpha-(1right3)-linkage. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:53456

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1232.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 207.0±6.0 kJ/mol
Flash Point: 699.3±34.3 °C
Index of Refraction: 1.651
Molar Refractivity: 187.3±0.4 cm3
#H bond acceptors: 26
#H bond donors: 15
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -1.36
ACD/LogD (pH 5.5): -2.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 404 Å2
Polarizability: 74.2±0.5 10-24cm3
Surface Tension: 101.1±5.0 dyne/cm
Molar Volume: 513.1±5.0 cm3

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