ChemSpider 2D Image | (2R,3S)-2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-O-beta-D-xylopyranosyl-beta-D-galactopyranoside | C26H30O15

(2R,3S)-2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-O-β-D-xylopyranosyl-β-D-galactopyranoside

  • Molecular FormulaC26H30O15
  • Average mass582.507 Da
  • Monoisotopic mass582.158447 Da
  • ChemSpider ID389234

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(2R,3S)-2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-O-β-D-xylopyranosyl-β-D-galactopyranoside [ACD/IUPAC Name]
(2R,3S)-2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl-6-O-β-D-xylopyranosyl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-2,3-dihydro-7-hydroxy-3-[(6-O-β-D-xylopyranosyl-β-D-galactopyranosyl)oxy]-, (2R,3S)- [ACD/Index Name]
6-O-β-D-Xylopyranosyl-β-D-galactopyranoside de (2R,3S)-2-(3,4-dihydroxyphényl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromén-3-yle [French] [ACD/IUPAC Name]
Flavonol 3-O-D-xylosylgalactoside

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

C04193 [DBID]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 952.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 145.3±3.0 kJ/mol
Flash Point: 318.3±27.8 °C
Index of Refraction: 1.739
Molar Refractivity: 132.5±0.4 cm3
#H bond acceptors: 15
#H bond donors: 9
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 1.67
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.29
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.93
Polar Surface Area: 245 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 116.3±5.0 dyne/cm
Molar Volume: 329.0±5.0 cm3

Click to predict properties on the Chemicalize site


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