Found 22 results

Search term: MF = 'C_{30}H_{36}O_{17}'
ChemSpider 2D Image | 3-(2-Hydroxy-4,5-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-4H-chromen-7-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside | C30H36O17

3-(2-Hydroxy-4,5-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-4H-chromen-7-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside

  • Molecular FormulaC30H36O17
  • Average mass668.597 Da
  • Monoisotopic mass668.195251 Da
  • ChemSpider ID9860879

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

3-(2-Hydroxy-4,5-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-4H-chromen-7-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside [ACD/IUPAC Name]
3-(2-Hydroxy-4,5-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-4H-chromen-7-yl-6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-(2-hydroxy-4,5-dimethoxyphenyl)-5,6-dimethoxy-7-[[6-O-[(2R,3R,4R)-tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-furanyl]-β-D-glucopyranosyl]oxy]- [ACD/Index Name]
6-O-[(2R,3R,4R)-3,4-Dihydroxy-4-(hydroxyméthyl)tétrahydro-2-furanyl]-β-D-glucopyranoside de 3-(2-hydroxy-4,5-diméthoxyphényl)-5,6-diméthoxy-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: 1.6±0.1 g/cm3
Boiling Point: 957.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 146.1±3.0 kJ/mol
Flash Point: 308.4±27.8 °C
Index of Refraction: 1.674
Molar Refractivity: 154.7±0.4 cm3
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 0.91
ACD/LogD (pH 5.5): -0.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.01
ACD/LogD (pH 7.4): -0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.82
Polar Surface Area: 242 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 90.4±5.0 dyne/cm
Molar Volume: 412.1±5.0 cm3

Click to predict properties on the Chemicalize site


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