ChemSpider 2D Image | 17-Hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl beta-D-glucopyranoside | C27H36O10

17-Hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl β-D-glucopyranoside

  • Molecular FormulaC27H36O10
  • Average mass520.569 Da
  • Monoisotopic mass520.230835 Da
  • ChemSpider ID8340461

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

17-Hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl β-D-glucopyranoside [ACD/IUPAC Name]
17-Hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Pregna-1,4-diene-3,11,20-trione, 21-(β-D-glucopyranosyloxy)-17-hydroxy- [ACD/Index Name]
β-D-Glucopyranoside de 17-hydroxy-3,11,20-trioxoprégna-1,4-dién-21-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 788.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.2 mmHg at 25°C
Enthalpy of Vaporization: 130.7±6.0 kJ/mol
Flash Point: 263.1±26.4 °C
Index of Refraction: 1.632
Molar Refractivity: 127.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.70
ACD/LogD (pH 7.4): -0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.70
Polar Surface Area: 171 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 73.6±5.0 dyne/cm
Molar Volume: 358.4±5.0 cm3

Click to predict properties on the Chemicalize site


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