ChemSpider 2D Image | 2-Hydroxy-1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]ethyl beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-[beta-D-gulopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-allopyran osyl-(1->3)]-beta-D-gulopyranoside | C40H68N2O30

2-Hydroxy-1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]ethyl β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-[β-D-gulopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyran osyl-(1->3)]-β-D-gulopyranoside

  • Molecular FormulaC40H68N2O30
  • Average mass1056.963 Da
  • Monoisotopic mass1056.385742 Da
  • ChemSpider ID8410763

  • defined stereocentres - 25 of 28 defined stereocentres

More details:

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

2-Hydroxy-1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]ethyl β-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->4)-[β-D-gulopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyran osyl-(1->3)]-β-D-gulopyranoside [ACD/IUPAC Name]
2-Hydroxy-1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]ethyl-β-D-galactopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-glucopyranosyl-(1->4)-[β-D-gulopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-allopyr anosyl-(1->3)]-β-D-gulopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-glucopyranosyl-(1->4)-[β-D-gulopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-allopyranosyl-(1->3)]-β-D-gulopyranoside de 2-hydroxy-1-[2- (hydroxyméthyl)-1,3-dioxolan-4-yl]éthyle [French] [ACD/IUPAC Name]
β-D-Gulopyranoside, 2-hydroxy-1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]ethyl O-β-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1->4)-O-[O-β-D-gulopyranosyl-(1->4)-2 -(acetylamino)-2-deoxy-β-D-allopyranosyl-(1->3)]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1408.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 240.9±6.0 kJ/mol
Flash Point: 805.6±34.3 °C
Index of Refraction: 1.658
Molar Refractivity: 227.4±0.4 cm3
#H bond acceptors: 32
#H bond donors: 18
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: -8.25
ACD/LogD (pH 5.5): -8.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 493 Å2
Polarizability: 90.1±0.5 10-24cm3
Surface Tension: 106.4±5.0 dyne/cm
Molar Volume: 617.1±5.0 cm3

Click to predict properties on the Chemicalize site


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