ChemSpider 2D Image | (3beta,13alpha,19alpha)-Urs-20(30)-en-3-ol | C30H50O

(3β,13α,19α)-Urs-20(30)-en-3-ol

  • Molecular FormulaC30H50O
  • Average mass426.717 Da
  • Monoisotopic mass426.386169 Da
  • ChemSpider ID29365048

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3β,13α,19α)-Urs-20(30)-en-3-ol [German] [ACD/IUPAC Name]
(3β,13α,19α)-Urs-20(30)-en-3-ol [ACD/IUPAC Name]
(3β,13α,19α)-Urs-20(30)-én-3-ol [French] [ACD/IUPAC Name]
Urs-20(30)-en-3-ol, (3β,13α,19α)- [ACD/Index Name]
(3S,4aR,6aR,6bR,8aR,12S,12aS,12bS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylenedocosahydropicen-3-ol
(3S,4Ar,6aS,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-ol
1059-14-9 [RN]
MFCD04039802 [MDL number]
taraxasterol

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 488.2±14.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.8 mmHg at 25°C
    Enthalpy of Vaporization: 86.9±6.0 kJ/mol
    Flash Point: 217.0±12.4 °C
    Index of Refraction: 1.534
    Molar Refractivity: 131.7±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 11.06
    ACD/LogD (pH 5.5): 9.94
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 6074842.00
    ACD/LogD (pH 7.4): 9.94
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 6074842.00
    Polar Surface Area: 20 Å2
    Polarizability: 52.2±0.5 10-24cm3
    Surface Tension: 38.6±5.0 dyne/cm
    Molar Volume: 423.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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