ChemSpider 2D Image | parkeol | C30H50O

parkeol

  • Molecular FormulaC30H50O
  • Average mass426.717 Da
  • Monoisotopic mass426.386169 Da
  • ChemSpider ID23255009
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(3β)-Lanosta-9(11),24-dien-3-ol [ACD/IUPAC Name]
(3β)-Lanosta-9(11),24-dien-3-ol [German] [ACD/IUPAC Name]
(3β)-Lanosta-9(11),24-dién-3-ol [French] [ACD/IUPAC Name]
Lanosta-9(11),24-dien-3-ol, (3β)- [ACD/Index Name]
parkeol
4,4,14α-trimethyl-5α-cholesta-9(11),24-dien-3β-ol
514-45-4 [RN]
5α-lanosta-9(11),24-dien-3β-ol
lanosta-9(11),24-dien-3β-ol
δ(9(11),24)-lanostadien-3β-ol

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

CHEBI:63460 [DBID]
  • Miscellaneous
    • Chemical Class:

      A tetracyclic triterpenoid comprised of a lanostane skeleton which is 3<stereo>beta</stereo>-hydroxylated and has double bonds at the 9(11)- and 24-positions. ChEBI CHEBI:63460

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

Density: 1.0±0.1 g/cm3
Boiling Point: 498.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.3±6.0 kJ/mol
Flash Point: 221.0±17.9 °C
Index of Refraction: 1.530
Molar Refractivity: 133.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 10.96
ACD/LogD (pH 5.5): 9.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 5218790.00
ACD/LogD (pH 7.4): 9.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 5218790.00
Polar Surface Area: 20 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 37.9±5.0 dyne/cm
Molar Volume: 432.6±5.0 cm3

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