Found 39 results

Search term: MF = 'C_{31}H_{43}NO_{6}'
ChemSpider 2D Image | (1R,7S,15S,17R)-7-{(1S,2E)-1-Hydroxy-3-[(2S)-4-methyl-3,6-dihydro-2H-pyran-2-yl]-2-propen-1-yl}-11-(methoxyimino)-15-methyl-13-methylene-6,21-dioxabicyclo[15.3.1]henicosa-3,9,19-trien-5-one | C31H43NO6

(1R,7S,15S,17R)-7-{(1S,2E)-1-Hydroxy-3-[(2S)-4-methyl-3,6-dihydro-2H-pyran-2-yl]-2-propen-1-yl}-11-(methoxyimino)-15-methyl-13-methylene-6,21-dioxabicyclo[15.3.1]henicosa-3,9,19-trien-5-one

  • Molecular FormulaC31H43NO6
  • Average mass525.676 Da
  • Monoisotopic mass525.309021 Da
  • ChemSpider ID9493419

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,7S,15S,17R)-7-{(1S,2E)-1-Hydroxy-3-[(2S)-4-methyl-3,6-dihydro-2H-pyran-2-yl]-2-propen-1-yl}-11-(methoxyimino)-15-methyl-13-methylen-6,21-dioxabicyclo[15.3.1]henicosa-3,9,19-trien-5-on [German] [ACD/IUPAC Name]
(1R,7S,15S,17R)-7-{(1S,2E)-1-Hydroxy-3-[(2S)-4-methyl-3,6-dihydro-2H-pyran-2-yl]-2-propen-1-yl}-11-(methoxyimino)-15-methyl-13-methylene-6,21-dioxabicyclo[15.3.1]henicosa-3,9,19-trien-5-one [ACD/IUPAC Name]
(1R,7S,15S,17R)-7-{(1S,2E)-1-Hydroxy-3-[(2S)-4-méthyl-3,6-dihydro-2H-pyran-2-yl]-2-propén-1-yl}-11-(méthoxyimino)-15-méthyl-13-méthylène-6,21-dioxabicyclo[15.3.1]hénicosa-3,9,19-trién-5-one [French] [ACD/IUPAC Name]
6,21-Dioxabicyclo[15.3.1]heneicosa-3,9,19-triene-5,11-dione, 7-[(1S,2E)-3-[(2S)-3,6-dihydro-4-methyl-2H-pyran-2-yl]-1-hydroxy-2-propen-1-yl]-15-methyl-13-methylene-, 11-(O-methyloxime), (1R,7S,15S,17R )- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 683.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.6±6.0 kJ/mol
Flash Point: 366.9±34.3 °C
Index of Refraction: 1.543
Molar Refractivity: 147.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1939.51
ACD/KOC (pH 5.5): 7851.04
ACD/LogD (pH 7.4): 4.63
ACD/BCF (pH 7.4): 1939.50
ACD/KOC (pH 7.4): 7851.01
Polar Surface Area: 87 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 38.6±7.0 dyne/cm
Molar Volume: 467.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement