ChemSpider 2D Image | (3alpha,12alpha,23S,24S,25S)-3,12-Dihydroxy-24-methyl-18,23:23,26-diepoxylanost-8-en-26-one | C31H48O5

(3α,12α,23S,24S,25S)-3,12-Dihydroxy-24-methyl-18,23:23,26-diepoxylanost-8-en-26-one

  • Molecular FormulaC31H48O5
  • Average mass500.710 Da
  • Monoisotopic mass500.350189 Da
  • ChemSpider ID78437093

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(3α,12α,23S,24S,25S)-3,12-Dihydroxy-24-methyl-18,23:23,26-diepoxylanost-8-en-26-on [German] [ACD/IUPAC Name]
(3α,12α,23S,24S,25S)-3,12-Dihydroxy-24-methyl-18,23:23,26-diepoxylanost-8-en-26-one [ACD/IUPAC Name]
(3α,12α,23S,24S,25S)-3,12-Dihydroxy-24-méthyl-18,23:23,26-diépoxylanost-8-én-26-one [French] [ACD/IUPAC Name]
Lanost-8-en-26-one, 18,23:23,26-diepoxy-3,12-dihydroxy-24-methyl-, (3α,12α,23S,24S,25S)- [ACD/Index Name]
Fomefficinol A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 636.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 107.8±6.0 kJ/mol
Flash Point: 201.5±25.0 °C
Index of Refraction: 1.569
Molar Refractivity: 139.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 5.20
ACD/BCF (pH 5.5): 5244.40
ACD/KOC (pH 5.5): 16001.13
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5244.40
ACD/KOC (pH 7.4): 16001.13
Polar Surface Area: 76 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 48.4±5.0 dyne/cm
Molar Volume: 425.4±5.0 cm3

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