ChemSpider 2D Image | (8alpha,9beta,11beta,14beta,23S,24S)-11,23,25-Trihydroxy-3-oxodammar-13(17)-en-24-yl acetate | C32H52O6

(8α,9β,11β,14β,23S,24S)-11,23,25-Trihydroxy-3-oxodammar-13(17)-en-24-yl acetate

  • Molecular FormulaC32H52O6
  • Average mass532.752 Da
  • Monoisotopic mass532.376404 Da
  • ChemSpider ID30783482

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(8α,9β,11β,14β,23S,24S)-11,23,25-Trihydroxy-3-oxodammar-13(17)-en-24-yl acetate [ACD/IUPAC Name]
(8α,9β,11β,14β,23S,24S)-11,23,25-Trihydroxy-3-oxodammar-13(17)-en-24-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (8α,9β,11β,14β,23S,24S)-11,23,25-trihydroxy-3-oxodammar-13(17)-én-24-yle [French] [ACD/IUPAC Name]
Dammar-13(17)-en-3-one, 24-(acetyloxy)-11,23,25-trihydroxy-, (8α,9β,11β,14β,23S,24S)- [ACD/Index Name]
(3S,4S,6R)-2,4-dihydroxy-6-((5R,8S,9S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-2,3,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptan-3-yl acetate
[(3S,4S,6R)-2,4-dihydroxy-6-[(5R,8S,9S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptan-3-yl] acetate
[18674-16-3] [RN]
18674-16-3 [RN]
725240-79-9 [RN]
Alisol A 24-acetate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 641.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±4.3 mmHg at 25°C
    Enthalpy of Vaporization: 108.4±6.0 kJ/mol
    Flash Point: 196.5±25.0 °C
    Index of Refraction: 1.547
    Molar Refractivity: 148.0±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 5.27
    ACD/LogD (pH 5.5): 5.60
    ACD/BCF (pH 5.5): 10546.70
    ACD/KOC (pH 5.5): 26383.73
    ACD/LogD (pH 7.4): 5.60
    ACD/BCF (pH 7.4): 10546.70
    ACD/KOC (pH 7.4): 26383.73
    Polar Surface Area: 104 Å2
    Polarizability: 58.7±0.5 10-24cm3
    Surface Tension: 47.6±5.0 dyne/cm
    Molar Volume: 466.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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