ChemSpider 2D Image | 4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl 2-O-(6-deoxy-beta-D-gulopyranosyl)-beta-D-allopyranoside | C27H30O14

4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl 2-O-(6-deoxy-β-D-gulopyranosyl)-β-D-allopyranoside

  • Molecular FormulaC27H30O14
  • Average mass578.519 Da
  • Monoisotopic mass578.163574 Da
  • ChemSpider ID10142707

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-O-(6-Désoxy-β-D-gulopyranosyl)-β-D-allopyranoside de 4-(5,7-dihydroxy-4-oxo-4H-chromén-3-yl)phényle [French] [ACD/IUPAC Name]
4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl 2-O-(6-deoxy-β-D-gulopyranosyl)-β-D-allopyranoside [ACD/IUPAC Name]
4-(5,7-Dihydroxy-4-oxo-4H-chromen-3-yl)phenyl-2-O-(6-desoxy-β-D-gulopyranosyl)-β-D-allopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[4-[[2-O-(6-deoxy-β-D-gulopyranosyl)-β-D-allopyranosyl]oxy]phenyl]-5,7-dihydroxy- [ACD/Index Name]
Sophorabioside

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

Density: 1.7±0.1 g/cm3
Boiling Point: 895.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 136.3±3.0 kJ/mol
Flash Point: 298.2±27.8 °C
Index of Refraction: 1.726
Molar Refractivity: 135.3±0.4 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.67
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.56
Polar Surface Area: 225 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 104.9±5.0 dyne/cm
Molar Volume: 340.4±5.0 cm3

Click to predict properties on the Chemicalize site


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