ChemSpider 2D Image | 13-Hydroxy-7-(6,12,13-trihydroxy-7-oxopodocarpa-5,8,11,13-tetraen-14-yl)podocarpa-7,9(11),13-triene-6,12-dione | C34H38O7

13-Hydroxy-7-(6,12,13-trihydroxy-7-oxopodocarpa-5,8,11,13-tetraen-14-yl)podocarpa-7,9(11),13-triene-6,12-dione

  • Molecular FormulaC34H38O7
  • Average mass558.661 Da
  • Monoisotopic mass558.261780 Da
  • ChemSpider ID29355672

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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[1,9'-Biphenanthrene]-6',10,10'(4bH)-trione, 1',2',3',4',4'a,5,6,7,8,10'a-decahydro-2,3,7',9-tetrahydroxy-1',1',4'a,4b,8,8-hexamethyl-, (4a'S,4bR,10a'S)- [ACD/Index Name]
13-Hydroxy-7-(6,12,13-trihydroxy-7-oxopodocarpa-5,8,11,13-tetraen-14-yl)podocarpa-7,9(11),13-trien-6,12-dion [German] [ACD/IUPAC Name]
13-Hydroxy-7-(6,12,13-trihydroxy-7-oxopodocarpa-5,8,11,13-tetraen-14-yl)podocarpa-7,9(11),13-triene-6,12-dione [ACD/IUPAC Name]
13-Hydroxy-7-(6,12,13-trihydroxy-7-oxopodocarpa-5,8,11,13-tétraén-14-yl)podocarpa-7,9(11),13-triène-6,12-dione [French] [ACD/IUPAC Name]
(p)-bicelaphanol A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 823.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.5±3.0 kJ/mol
Flash Point: 465.7±30.8 °C
Index of Refraction: 1.671
Molar Refractivity: 150.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 7.37
ACD/LogD (pH 5.5): 5.54
ACD/BCF (pH 5.5): 5053.18
ACD/KOC (pH 5.5): 7378.54
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 23.69
ACD/KOC (pH 7.4): 34.59
Polar Surface Area: 132 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 69.5±5.0 dyne/cm
Molar Volume: 403.8±5.0 cm3

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