ChemSpider 2D Image | 6-Hydroxy-3,5-dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside | C26H30O15

6-Hydroxy-3,5-dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside

  • Molecular FormulaC26H30O15
  • Average mass582.507 Da
  • Monoisotopic mass582.158447 Da
  • ChemSpider ID9895928

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

6-Hydroxy-3,5-dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside [ACD/IUPAC Name]
6-Hydroxy-3,5-dimethoxy-9-oxo-9H-xanthen-1-yl-6-O-β-D-xylopyranosyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-β-D-Xylopyranosyl-β-D-glucopyranoside de 6-hydroxy-3,5-diméthoxy-9-oxo-9H-xanthén-1-yle [French] [ACD/IUPAC Name]
9H-Xanthen-9-one, 6-hydroxy-3,5-dimethoxy-1-[(6-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]- [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: 923.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.8±3.0 kJ/mol
Flash Point: 308.6±27.8 °C
Index of Refraction: 1.699
Molar Refractivity: 133.0±0.4 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 0.10
ACD/LogD (pH 5.5): -0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.78
ACD/LogD (pH 7.4): -0.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.38
Polar Surface Area: 223 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 99.6±5.0 dyne/cm
Molar Volume: 344.3±5.0 cm3

Click to predict properties on the Chemicalize site


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