ChemSpider 2D Image | Borapetoside F | C27H34O11

Borapetoside F

  • Molecular FormulaC27H34O11
  • Average mass534.552 Da
  • Monoisotopic mass534.210083 Da
  • ChemSpider ID10250121

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2S,6S,6aR,10aS,10bS)-2-(3-Furyl)-6-(β-D-glucopyranosyloxy)-6a,10b-diméthyl-4-oxo-1,4,6,6a,9,10,10a,10b-octahydro-2H-benzo[f]isochromène-7-carboxylate de méthyle [French] [ACD/IUPAC Name]
2H-Naphtho[2,1-c]pyran-7-carboxylic acid, 2-(3-furanyl)-6-(β-D-glucopyranosyloxy)-1,4,6,6a,9,10,10a,10b-octahydro-6a,10b-dimethyl-4-oxo-, methyl ester, (2S,6S,6aR,10aS,10bS)- [ACD/Index Name]
Borapetoside F
Methyl (2S,6S,6aR,10aS,10bS)-2-(3-furyl)-6-(β-D-glucopyranosyloxy)-6a,10b-dimethyl-4-oxo-1,4,6,6a,9,10,10a,10b-octahydro-2H-benzo[f]isochromene-7-carboxylate [ACD/IUPAC Name]
Methyl-(2S,6S,6aR,10aS,10bS)-2-(3-furyl)-6-(β-D-glucopyranosyloxy)-6a,10b-dimethyl-4-oxo-1,4,6,6a,9,10,10a,10b-octahydro-2H-benzo[f]isochromen-7-carboxylat [German] [ACD/IUPAC Name]
151200-50-9 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 749.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 407.3±32.9 °C
Index of Refraction: 1.619
Molar Refractivity: 130.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.77
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.24
ACD/KOC (pH 5.5): 97.93
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.24
ACD/KOC (pH 7.4): 97.93
Polar Surface Area: 165 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 68.2±5.0 dyne/cm
Molar Volume: 371.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement