ChemSpider 2D Image | (3alpha,15alpha,24E)-15-Acetoxy-3-hydroxylanosta-7,9(11),24-trien-26-oic acid | C32H48O5

(3α,15α,24E)-15-Acetoxy-3-hydroxylanosta-7,9(11),24-trien-26-oic acid

  • Molecular FormulaC32H48O5
  • Average mass512.721 Da
  • Monoisotopic mass512.350159 Da
  • ChemSpider ID58802421

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3α,15α,24E)-15-Acetoxy-3-hydroxylanosta-7,9(11),24-trien-26-oic acid [ACD/IUPAC Name]
(3α,15α,24E)-15-Acetoxy-3-hydroxylanosta-7,9(11),24-trien-26-säure [German] [ACD/IUPAC Name]
86377-53-9 [RN]
Acide (3α,15α,24E)-15-acétoxy-3-hydroxylanosta-7,9(11),24-trién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-7,9(11),24-trien-26-oic acid, 15-(acetyloxy)-3-hydroxy-, (3α,15α,24E)- [ACD/Index Name]
(E,6R)-6-[(3R,5R,10S,13R,14R,15S,17R)-15-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Ganoderic acid X

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 625.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±4.1 mmHg at 25°C
    Enthalpy of Vaporization: 106.2±6.0 kJ/mol
    Flash Point: 193.1±25.0 °C
    Index of Refraction: 1.555
    Molar Refractivity: 146.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 7.87
    ACD/LogD (pH 5.5): 6.67
    ACD/BCF (pH 5.5): 49212.32
    ACD/KOC (pH 5.5): 53196.55
    ACD/LogD (pH 7.4): 4.91
    ACD/BCF (pH 7.4): 851.00
    ACD/KOC (pH 7.4): 919.90
    Polar Surface Area: 84 Å2
    Polarizability: 57.9±0.5 10-24cm3
    Surface Tension: 46.2±5.0 dyne/cm
    Molar Volume: 454.8±5.0 cm3

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