ChemSpider 2D Image | 4-[7-(beta-D-Glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromen-3-yl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside | C33H40O19

4-[7-(β-D-Glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromen-3-yl]phenyl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC33H40O19
  • Average mass740.659 Da
  • Monoisotopic mass740.216370 Da
  • ChemSpider ID9311502

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de 4-[7-(β-D-glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromén-3-yl]phényle [French] [ACD/IUPAC Name]
4-[7-(β-D-Glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromen-3-yl]phenyl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
4-[7-(β-D-Glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromen-3-yl]phenyl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[4-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]phenyl]-7-(β-D-glucopyranosyloxy)-5-hydroxy- [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: 1066.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 163.6±3.0 kJ/mol
Flash Point: 336.2±27.8 °C
Index of Refraction: 1.729
Molar Refractivity: 169.1±0.4 cm3
#H bond acceptors: 19
#H bond donors: 11
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 0.33
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.33
ACD/LogD (pH 7.4): -2.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 304 Å2
Polarizability: 67.0±0.5 10-24cm3
Surface Tension: 112.8±5.0 dyne/cm
Molar Volume: 424.1±5.0 cm3

Click to predict properties on the Chemicalize site


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