ChemSpider 2D Image | Kulinone | C30H48O2

Kulinone

  • Molecular FormulaC30H48O2
  • Average mass440.701 Da
  • Monoisotopic mass440.365417 Da
  • ChemSpider ID23340021

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(13α,14β,16β,17α)-16-Hydroxylanosta-7,24-dien-3-on [German] [ACD/IUPAC Name]
(13α,14β,16β,17α)-16-Hydroxylanosta-7,24-dien-3-one [ACD/IUPAC Name]
(13α,14β,16β,17α)-16-Hydroxylanosta-7,24-dién-3-one [French] [ACD/IUPAC Name]
21688-61-9 [RN]
Kulinone
Lanosta-7,24-dien-3-one, 16-hydroxy-, (13α,14β,16β,17α)- [ACD/Index Name]
(5R,9R,10R,13S,14S,16S,17S)-16-hydroxy-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL464491/
Lanosta-7,24-dien-3-one,16-hydroxy-,(13α,14β,16β,17α)-

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 526.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.1 mmHg at 25°C
    Enthalpy of Vaporization: 92.1±6.0 kJ/mol
    Flash Point: 222.1±22.7 °C
    Index of Refraction: 1.535
    Molar Refractivity: 133.7±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 8.53
    ACD/LogD (pH 5.5): 7.87
    ACD/BCF (pH 5.5): 566968.75
    ACD/KOC (pH 5.5): 457055.41
    ACD/LogD (pH 7.4): 7.87
    ACD/BCF (pH 7.4): 566968.75
    ACD/KOC (pH 7.4): 457055.41
    Polar Surface Area: 37 Å2
    Polarizability: 53.0±0.5 10-24cm3
    Surface Tension: 39.8±5.0 dyne/cm
    Molar Volume: 429.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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