ChemSpider 2D Image | Man3GlcNAc2 | C34H58N2O26

Man3GlcNAc2

  • Molecular FormulaC34H58N2O26
  • Average mass910.822 Da
  • Monoisotopic mass910.327759 Da
  • ChemSpider ID4450981

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

Man3GlcNAc2
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranose [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranose [French] [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-deoxy-2-[(E)-(1-hydroxyethylidene)amino]-β-D-glucopyranosyl-(1->4)-2-deoxy-2-[(E)-(1-hydroxyethylidene)a mino]-β-D-glucopyranose [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-desoxy-2-[(E)-(1-hydroxyethyliden)amino]-β-D-glucopyranosyl-(1->4)-2-desoxy-2-[(E)-(1-hydroxyethyliden)a mino]-β-D-glucopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranosyl-(1->3)-[α-D-mannopyranosyl-(1->6)]-β-D-mannopyranosyl-(1->4)-2-désoxy-2-[(E)-(1-hydroxyéthylidène)amino]-β-D-glucopyranosyl-(1->4)-2-désoxy-2-[(E)-(1-hydroxyéthylidène )amino]-β-D-glucopyranose [French] [ACD/IUPAC Name]
α-D-Manp-(1->3)-[α-D-Manp-(1->6)]-β-D-Manp-(1->4)-β-D-GlcpNAc-(1->4)-β-D-GlcpNAc
β-D-Glucopyranose, O-α-D-mannopyranosyl-(1->3)-O-[α-D-mannopyranosyl-(1->6)]-O-β-D-mannopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-2-(acetylamino)-2-deoxy- [ACD/Index Name]
β-D-Glucopyranose, O-α-D-mannopyranosyl-(1->3)-O-[α-D-mannopyranosyl-(1->6)]-O-β-D-mannopyranosyl-(1->4)-O-2-deoxy-2-[[(1E)-1-hydroxyethylidene]amino]-β-D-glucopyranosyl-(1->4)-2-deox y-2-[[(1E)-1-hydroxyethylidene]amino]- [ACD/Index Name]
More...
  • Miscellaneous

    • Chemical Class:

      <stereo>alpha</stereo>-<stereo>D</stereo>-Man<ringsugar>p</ringsugar>-(1<arrow>right</arrow>3)-[<stereo>alpha</stereo>-<stereo>D</stereo>-Man<ringsugar>p</ringsugar>-(1<arrow>right</arrow>6)]-<stereo> beta</stereo>-<stereo>D</stereo>-Man<ringsugar>p</ringsugar>-(1<arrow>right</arrow>4)-<stereo>beta</stereo>-<stereo>D</stereo>-Glc<ringsugar>p</ringsugar>NAc-(1<arrow>right</arrow>4)-<stereo>D</stereo >-Glc<ringsugar>p</ringsugar>NAc in which the anomeric configuration of the reducing-end GlcNAc residue is <stereo>beta</stereo>. ChEBI CHEBI:71495
      alpha-D-Manp-(1right3)-[alpha-D-Manp-(1right6)]-; beta-D-Manp-(1right4)-beta-D-GlcpNAc-(1right4)-D-GlcpNAc in which the anomeric configuration of the reducing-end GlcNAc residue is beta. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:71495

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.0±0.1 g/cm3
Boiling Point: 1286.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 217.1±6.0 kJ/mol
Flash Point: 731.7±37.1 °C
Index of Refraction: 1.718
Molar Refractivity: 179.2±0.5 cm3
#H bond acceptors: 28
#H bond donors: 17
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -5.03
ACD/LogD (pH 5.5): -5.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 452 Å2
Polarizability: 71.1±0.5 10-24cm3
Surface Tension: 86.5±7.0 dyne/cm
Molar Volume: 454.7±7.0 cm3

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