ChemSpider 2D Image | (3beta,5xi,22S,24S)-22,25-Epoxylanosta-7,9(11)-diene-3,24-diol | C30H48O3

(3β,5ξ,22S,24S)-22,25-Epoxylanosta-7,9(11)-diene-3,24-diol

  • Molecular FormulaC30H48O3
  • Average mass456.700 Da
  • Monoisotopic mass456.360352 Da
  • ChemSpider ID78441218

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(3β,5ξ,22S,24S)-22,25-Epoxylanosta-7,9(11)-dien-3,24-diol [German] [ACD/IUPAC Name]
(3β,5ξ,22S,24S)-22,25-Epoxylanosta-7,9(11)-diene-3,24-diol [ACD/IUPAC Name]
(3β,5ξ,22S,24S)-22,25-Époxylanosta-7,9(11)-diène-3,24-diol [French] [ACD/IUPAC Name]
Lanosta-7,9(11)-diene-3,24-diol, 22,25-epoxy-, (3β,5ξ,22S,24S)- [ACD/Index Name]
Ganoderchochlearin B

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

Density: 1.1±0.1 g/cm3
Boiling Point: 567.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.9±6.0 kJ/mol
Flash Point: 297.2±30.1 °C
Index of Refraction: 1.558
Molar Refractivity: 134.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.22
ACD/LogD (pH 5.5): 6.87
ACD/BCF (pH 5.5): 98696.62
ACD/KOC (pH 5.5): 130767.81
ACD/LogD (pH 7.4): 6.87
ACD/BCF (pH 7.4): 98696.62
ACD/KOC (pH 7.4): 130767.81
Polar Surface Area: 50 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 43.8±5.0 dyne/cm
Molar Volume: 418.1±5.0 cm3

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