ChemSpider 2D Image | 6-Methoxy-2-oxo-2H-chromen-7-yl 6-O-(6-deoxyhexopyranosyl)hexopyranoside | C22H28O13

6-Methoxy-2-oxo-2H-chromen-7-yl 6-O-(6-deoxyhexopyranosyl)hexopyranoside

  • Molecular FormulaC22H28O13
  • Average mass500.450 Da
  • Monoisotopic mass500.152985 Da
  • ChemSpider ID12944919

More details:






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

2H-1-Benzopyran-2-one, 7-[[6-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy]-6-methoxy- [ACD/Index Name]
6-Methoxy-2-oxo-2H-chromen-7-yl 6-O-(6-deoxyhexopyranosyl)hexopyranoside [ACD/IUPAC Name]
6-Methoxy-2-oxo-2H-chromen-7-yl-6-O-(6-desoxyhexopyranosyl)hexopyranosid [German] [ACD/IUPAC Name]
6-O-(6-Désoxyhexopyranosyl)hexopyranoside de 6-méthoxy-2-oxo-2H-chromén-7-yle [French] [ACD/IUPAC Name]
6-methoxy-7-{3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyl(2H-3,4,5,6-tetrahydropyran-2-yloxy))methyl](2H-3,4,5,6-tetrahydropyran-2-yl)oxy}chromen-2-one
97938-28-8 [RN]
Haploperoside C

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 794.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.1±3.0 kJ/mol
Flash Point: 273.3±26.4 °C
Index of Refraction: 1.657
Molar Refractivity: 114.2±0.4 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 0.30
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.68
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.68
Polar Surface Area: 194 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 86.9±5.0 dyne/cm
Molar Volume: 310.3±5.0 cm3

Click to predict properties on the Chemicalize site






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