ChemSpider 2D Image | (5alpha,7beta,12alpha)-7,12-Dihydroxy-4,4,14-trimethyl-20,24-epoxychol-8-ene-3,11,15,24-tetrone | C27H36O7

(5α,7β,12α)-7,12-Dihydroxy-4,4,14-trimethyl-20,24-epoxychol-8-ene-3,11,15,24-tetrone

  • Molecular FormulaC27H36O7
  • Average mass472.570 Da
  • Monoisotopic mass472.246094 Da
  • ChemSpider ID59004408

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(5α,7β,12α)-7,12-Dihydroxy-4,4,14-trimethyl-20,24-epoxychol-8-en-3,11,15,24-tetron [German] [ACD/IUPAC Name]
(5α,7β,12α)-7,12-Dihydroxy-4,4,14-trimethyl-20,24-epoxychol-8-ene-3,11,15,24-tetrone [ACD/IUPAC Name]
(5α,7β,12α)-7,12-Dihydroxy-4,4,14-triméthyl-20,24-époxychol-8-ène-3,11,15,24-tétrone [French] [ACD/IUPAC Name]
Chol-8-ene-3,11,15,24-tetrone, 20,24-epoxy-7,12-dihydroxy-4,4,14-trimethyl-, (5α,7β,12α)- [ACD/Index Name]
Ganoderlactone A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 678.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.9±6.0 kJ/mol
Flash Point: 226.1±25.0 °C
Index of Refraction: 1.585
Molar Refractivity: 121.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.22
ACD/KOC (pH 5.5): 196.45
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.22
ACD/KOC (pH 7.4): 196.45
Polar Surface Area: 118 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 56.3±5.0 dyne/cm
Molar Volume: 362.4±5.0 cm3

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