ChemSpider 2D Image | 3-{[6-O-(6-Deoxyhexopyranosyl)hexopyranosyl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 6-deoxyhexopyranoside | C33H40O20

3-{[6-O-(6-Deoxyhexopyranosyl)hexopyranosyl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 6-deoxyhexopyranoside

  • Molecular FormulaC33H40O20
  • Average mass756.659 Da
  • Monoisotopic mass756.211304 Da
  • ChemSpider ID22370202

More details:

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

3-{[6-O-(6-Deoxyhexopyranosyl)hexopyranosyl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 6-deoxyhexopyranoside [ACD/IUPAC Name]
3-{[6-O-(6-Desoxyhexopyranosyl)hexopyranosyl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl-6-desoxyhexopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[[6-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy]-7-[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy- [ACD/Index Name]
6-Désoxyhexopyranoside de 3-{[6-O-(6-désoxyhexopyranosyl)hexopyranosyl]oxy}-2-(3,4-dihydroxyphényl)-5-hydroxy-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1101.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 169.5±3.0 kJ/mol
Flash Point: 346.3±27.8 °C
Index of Refraction: 1.744
Molar Refractivity: 170.4±0.4 cm3
#H bond acceptors: 20
#H bond donors: 12
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.52
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 324 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 120.4±5.0 dyne/cm
Molar Volume: 420.6±5.0 cm3

Click to predict properties on the Chemicalize site


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