ChemSpider 2D Image | renillafoulin A | C24H32O9

renillafoulin A

  • Molecular FormulaC24H32O9
  • Average mass464.505 Da
  • Monoisotopic mass464.204620 Da
  • ChemSpider ID30791734

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(1R,3aS,4Z,8R,8aS,12S,12aS,13S,13aS)-12,13a-Dihydroxy-1,5,8a,12-tetramethyl-2,11-dioxo-1,2,3a,6,7,8,8a,11,12,12a,13,13a-dodecahydrobenzo[4,5]cyclodeca[1,2-b]furan-8,13-diyl diacetate [ACD/IUPAC Name]
(1R,3aS,4Z,8R,8aS,12S,12aS,13S,13aS)-12,13a-Dihydroxy-1,5,8a,12-tetramethyl-2,11-dioxo-1,2,3a,6,7,8,8a,11,12,12a,13,13a-dodecahydrobenzo[4,5]cyclodeca[1,2-b]furan-8,13-diyl-diacetat [German] [ACD/IUPAC Name]
Benzo[4,5]cyclodeca[1,2-b]furan-2,11(1H,3aH)-dione, 8,13-bis(acetyloxy)-6,7,8,8a,12,12a,13,13a-octahydro-12,13a-dihydroxy-1,5,8a,12-tetramethyl-, (1R,3aS,4Z,8R,8aS,12S,12aS,13S,13aS)- [ACD/Index Name]
Diacétate de (1R,3aS,4Z,8R,8aS,12S,12aS,13S,13aS)-12,13a-dihydroxy-1,5,8a,12-tétraméthyl-2,11-dioxo-1,2,3a,6,7,8,8a,11,12,12a,13,13a-dodécahydrobenzo[4,5]cyclodéca[1,2-b]furane-8,13-diyle [French] [ACD/IUPAC Name]
renillafoulin A
(1R,3aS,4Z,8R,8aS,12aS,13S,13aS)-12,13a-Dihydroxy-1,5,8a,12-tetramethyl-2,11-dioxo-1,2,3a,6,7,8,8a,11,12,12a,13,13a-dodecahydrobenzo[4,5]cyclodeca[1,2-b]furan-8,13-diyl diacetate
104715-93-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 585.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.5±6.0 kJ/mol
Flash Point: 193.0±23.6 °C
Index of Refraction: 1.559
Molar Refractivity: 115.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.19
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.20
ACD/KOC (pH 5.5): 232.46
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 14.19
ACD/KOC (pH 7.4): 232.44
Polar Surface Area: 136 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 356.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement