ChemSpider 2D Image | 4-deoxy-alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-NHAc | C20H35NO15

4-deoxy-α-D-Gal-(1->3)-β-D-Gal-(1->4)-β-D-Glc-NHAc

  • Molecular FormulaC20H35NO15
  • Average mass529.490 Da
  • Monoisotopic mass529.200684 Da
  • ChemSpider ID9299403

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

4-deoxy-α-D-Gal-(1->3)-β-D-Gal-(1->4)-β-D-Glc-NHAc
4-Deoxy-α-D-xylo-hexopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-N-acetyl-β-D-glucopyranosylamine [ACD/IUPAC Name]
4-Desoxy-α-D-xylo-hexopyranosyl-(1->;3)-β-D-galactopyranosyl-(1->4)-N-acetyl-β-D-glucopyranosylamin [German] [ACD/IUPAC Name]
4-Désoxy-α-D-xylo-hexopyranosyl-(1->;3)-β-D-galactopyranosyl-(1->4)-N-acétyl-β-D-glucopyranosylamine [French] [ACD/IUPAC Name]
β-D-Glucopyranosylamine, O-4-deoxy-α-D-xylo-hexopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->4)-N-acetyl- [ACD/Index Name]
3-deoxy-α-D-galactosyl-(1->3)-β-D-galactosyl-(1->4)-N-acetyl-β-D-glucosylamine
missing
  • Miscellaneous

    • Chemical Class:

      The <element>N</element>-glycosyl compound formed from the deoxy trisaccharide 4-deoxy-<stereo>alpha</stereo>-<stereo>D</stereo>-Gal-(1<arrow>right</arrow>3)-<stereo>beta</stereo>-<stereo>D</stereo>-G al-(1<arrow>right</arrow>4)-<stereo>beta</stereo>-<stereo>D</stereo>-Glc by replacement of the OH at the anomeric centre of the glucose residue by an acetylamino group. ChEBI CHEBI:62060
      The N-glycosyl compound formed from the deoxy trisaccharide 4-deoxy-alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc by replacement of the OH at the anomeric centre of the glucose residue by an acetyla mino group. ChEBI CHEBI:62060
      The N-glycosyl compound formed from the deoxy trisaccharide 4-deoxy-alpha-D-Gal-(1right3)-beta-D-G; al-(1right4)-beta-D-Glc by replacement of the OH at the anomeric centre of the glucose residue by an acetylamino group. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:62060

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

Density: 1.7±0.1 g/cm3
Boiling Point: 951.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 157.1±6.0 kJ/mol
Flash Point: 529.4±34.3 °C
Index of Refraction: 1.635
Molar Refractivity: 114.5±0.4 cm3
#H bond acceptors: 16
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -2.00
ACD/LogD (pH 5.5): -2.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 257 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 96.3±5.0 dyne/cm
Molar Volume: 320.0±5.0 cm3

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