ChemSpider 2D Image | (3beta,5xi,22R)-Lanosta-8,24-diene-3,21,22-triol | C30H50O3

(3β,5ξ,22R)-Lanosta-8,24-diene-3,21,22-triol

  • Molecular FormulaC30H50O3
  • Average mass458.716 Da
  • Monoisotopic mass458.376007 Da
  • ChemSpider ID28286098

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(3β,5ξ,22R)-Lanosta-8,24-dien-3,21,22-triol [German] [ACD/IUPAC Name]
(3β,5ξ,22R)-Lanosta-8,24-diene-3,21,22-triol [ACD/IUPAC Name]
(3β,5ξ,22R)-Lanosta-8,24-diène-3,21,22-triol [French] [ACD/IUPAC Name]
Lanosta-8,24-diene-3,21,22-triol, (3β,5ξ,22R)- [ACD/Index Name]
inoterpene D

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

Density: 1.1±0.1 g/cm3
Boiling Point: 577.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 99.2±6.0 kJ/mol
Flash Point: 236.1±24.7 °C
Index of Refraction: 1.552
Molar Refractivity: 136.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.69
ACD/LogD (pH 5.5): 7.30
ACD/BCF (pH 5.5): 206672.33
ACD/KOC (pH 5.5): 221949.83
ACD/LogD (pH 7.4): 7.30
ACD/BCF (pH 7.4): 206672.33
ACD/KOC (pH 7.4): 221949.83
Polar Surface Area: 61 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 44.7±5.0 dyne/cm
Molar Volume: 427.0±5.0 cm3

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