ChemSpider 2D Image | 11-keto-16?-hydroxyprednisolone | C21H26O6

11-keto-16?-hydroxyprednisolone

  • Molecular FormulaC21H26O6
  • Average mass374.427 Da
  • Monoisotopic mass374.172943 Da
  • ChemSpider ID48063834

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(16α)-16,17,21-Trihydroxypregna-1,4-dien-3,11,20-trion [German] [ACD/IUPAC Name]
(16α)-16,17,21-Trihydroxypregna-1,4-diene-3,11,20-trione [ACD/IUPAC Name]
(16α)-16,17,21-Trihydroxyprégna-1,4-diène-3,11,20-trione [French] [ACD/IUPAC Name]
11-keto-16?-hydroxyprednisolone
3754-05-0 [RN]
Pregna-1,4-diene-3,11,20-trione, 16,17,21-trihydroxy-, (16α)- [ACD/Index Name]
(8S,9S,10R,13S,14S,16R,17S)-16,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione
11-Keto-16α-hydroxyprednisolone
11-KETO-16α-HYDROXYPREDNISOLONE
16??,17,21-Trihydroxy-pregna-1,4-diene-3,11,20-trione
More...

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

9UUI9HUO3Q [DBID]
UNII:9UUI9HUO3Q [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 594.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.8 mmHg at 25°C
    Enthalpy of Vaporization: 101.7±6.0 kJ/mol
    Flash Point: 327.5±26.6 °C
    Index of Refraction: 1.622
    Molar Refractivity: 95.6±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.20
    ACD/LogD (pH 5.5): 1.02
    ACD/BCF (pH 5.5): 3.48
    ACD/KOC (pH 5.5): 85.02
    ACD/LogD (pH 7.4): 1.02
    ACD/BCF (pH 7.4): 3.48
    ACD/KOC (pH 7.4): 85.02
    Polar Surface Area: 112 Å2
    Polarizability: 37.9±0.5 10-24cm3
    Surface Tension: 65.3±5.0 dyne/cm
    Molar Volume: 271.6±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement