ChemSpider 2D Image | (3beta,5beta)-5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide | C28H40O10

(3β,5β)-5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide

  • Molecular FormulaC28H40O10
  • Average mass536.611 Da
  • Monoisotopic mass536.262146 Da
  • ChemSpider ID17467813
  • defined stereocentres - 8 of 12 defined stereocentres


More details:






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

(3β,5β)-5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolid [German] [ACD/IUPAC Name]
(3β,5β)-5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide [ACD/IUPAC Name]
(3β,5β)-5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 5,14-dihydroxy-19-oxo-3-(pentopyranosyloxy)-, (3β,5β)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 757.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.8 mmHg at 25°C
Enthalpy of Vaporization: 126.0±6.0 kJ/mol
Flash Point: 249.9±26.4 °C
Index of Refraction: 1.630
Molar Refractivity: 132.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 0.32
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.33
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.33
Polar Surface Area: 163 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 73.0±5.0 dyne/cm
Molar Volume: 372.1±5.0 cm3

Click to predict properties on the Chemicalize site






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