ChemSpider 2D Image | 4-{7-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-5-hydroxy-4-oxo-4H-chromen-3-yl}phenyl 6-deoxy-alpha-L-mannopyranoside | C27H30O13

4-{7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-4-oxo-4H-chromen-3-yl}phenyl 6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC27H30O13
  • Average mass562.519 Da
  • Monoisotopic mass562.168640 Da
  • ChemSpider ID22842364

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

4-{7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-4-oxo-4H-chromen-3-yl}phenyl 6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
4-{7-[(6-Desoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-4-oxo-4H-chromen-3-yl}phenyl-6-desoxy-α-L-mannopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 7-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]phenyl]-5-hydroxy- [ACD/Index Name]
6-Désoxy-α-L-mannopyranoside de 4-{7-[(6-désoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-4-oxo-4H-chromén-3-yl}phényle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 858.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.8±3.0 kJ/mol
Flash Point: 286.9±27.8 °C
Index of Refraction: 1.683
Molar Refractivity: 134.5±0.3 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 1.57
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.06
ACD/LogD (pH 7.4): -1.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.38
Polar Surface Area: 205 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 83.5±3.0 dyne/cm
Molar Volume: 354.7±3.0 cm3

Click to predict properties on the Chemicalize site


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