ChemSpider 2D Image | 2-Acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranuronic acid | C28H44N2O23

2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronic acid

  • Molecular FormulaC28H44N2O23
  • Average mass776.649 Da
  • Monoisotopic mass776.233459 Da
  • ChemSpider ID8415991

  • defined stereocentres - 20 of 20 defined stereocentres

More details:

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

2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronic acid [ACD/IUPAC Name]
2-Acetamido-2-desoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronosyl-(1->3)-2-acetamido-2-desoxy-β-D-galactopyranosyl-(1->;4)-β-D-glucopyranuronsäure [German] [ACD/IUPAC Name]
Acide 2-acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronosyl-(1->3)-2-acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-β-D-glucopyranuronique [French] [ACD/IUPAC Name]
β-D-Glucopyranuronic acid, O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-β-D-glucopyranuronosyl-(1->3)-O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1257.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 211.7±6.0 kJ/mol
Flash Point: 714.5±34.3 °C
Index of Refraction: 1.666
Molar Refractivity: 161.5±0.4 cm3
#H bond acceptors: 25
#H bond donors: 14
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -3.21
ACD/LogD (pH 5.5): -8.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 400 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 113.5±5.0 dyne/cm
Molar Volume: 434.0±5.0 cm3

Click to predict properties on the Chemicalize site


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