ChemSpider 2D Image | sartorypyrone B | C30H42O7

sartorypyrone B

  • Molecular FormulaC30H42O7
  • Average mass514.650 Da
  • Monoisotopic mass514.293030 Da
  • ChemSpider ID30771090

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2R,3S,4aR,4bR,6aS,12aS,12bR,14aR)-1,1,4a,6a,9,12b-Hexamethyl-11-oxo-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1H,11H-naphtho[2,1-f]pyrano[2,3-b]chromen-2,3-diyl-diacetat [German] [ACD/IUPAC Name]
(2R,3S,4aR,4bR,6aS,12aS,12bR,14aR)-1,1,4a,6a,9,12b-Hexamethyl-11-oxo-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1H,11H-naphtho[2,1-f]pyrano[2,3-b]chromene-2,3-diyl diacetate [ACD/IUPAC Name]
1452396-11-0 [RN]
1H,11H-Phenanthro[2,1-b]pyrano[3,2-e]pyran-11-one, 2,3-bis(acetyloxy)-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-1,1,4a,6a,9,12b-hexamethyl-, (2R,3S,4aR,4bR,6aS,12aS,12bR,14aR)- [ACD/Index Name]
Diacétate de (2R,3S,4aR,4bR,6aS,12aS,12bR,14aR)-1,1,4a,6a,9,12b-hexaméthyl-11-oxo-2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tétradécahydro-1H,11H-naphto[2,1-f]pyrano[2,3-b]chromène-2,3-diyle [French] [ACD/IUPAC Name]
sartorypyrone B

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

Density: 1.2±0.1 g/cm3
Boiling Point: 582.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 244.0±30.2 °C
Index of Refraction: 1.550
Molar Refractivity: 137.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 5.85
ACD/BCF (pH 5.5): 16409.67
ACD/KOC (pH 5.5): 36203.90
ACD/LogD (pH 7.4): 5.85
ACD/BCF (pH 7.4): 16409.67
ACD/KOC (pH 7.4): 36203.90
Polar Surface Area: 88 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 430.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement