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

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

  • Molecular FormulaC26H45NO21
  • Average mass707.630 Da
  • Monoisotopic mass707.248413 Da
  • ChemSpider ID4443269

  • 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-glucopyranosyl-(1->;3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->3)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->3)-β-D-galactopyranosyl-(1->4)-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Galp-(1->3)-β-D-GlcpNAc-(1->3)-β-D-Galp-(1->4)-β-D-Glcp
β-D-Glucopyranose, O-β-D-galactopyranosyl-(1->3)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->3)-O-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]
13007-32-4 [RN]
Galb1-3GlcNAcb1-3Galb1-4Glcb
Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glcbeta
Lacto-N-neo-tetraose
Lacto-N-tetraose
More...

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

AIDS334770 [DBID]
AIDS-334770 [DBID]
  • Miscellaneous

    • Chemical Class:

      A <stereo>beta</stereo>-<stereo>D</stereo>-Gal-(1<arrow>right</arrow>3)-<stereo>beta</stereo>-<stereo>D</stereo>-GlcNAc-(1<arrow>right</arrow>3)-<stereo>beta</stereo>-<stereo>D</stereo>-Gal-(1<arrow>r ight</arrow>4)-<stereo>D</stereo>-Glc having <stereo>beta</stereo>-configuration at the reducing end anomeric centre. ChEBI CHEBI:53481
      A beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc having beta-configuration at the reducing end anomeric centre. ChEBI CHEBI:53481
      A beta-D-Gal-(1right3)-beta-D-GlcNAc-(1right3)-beta-D-Gal-(1r; ight4)-D-Glc having beta-configuration at the reducing end anomeric centre. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:53481

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1116.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 185.6±6.0 kJ/mol
Flash Point: 628.8±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: -3.61
ACD/LogD (pH 5.5): -4.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.53
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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