ChemSpider 2D Image | (3R,4aS,5S,6S,6aS,10S,10aS,10bR)-10-Hydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromene-5,6-diyl diacetate | C24H36O7

(3R,4aS,5S,6S,6aS,10S,10aS,10bR)-10-Hydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromene-5,6-diyl diacetate

  • Molecular FormulaC24H36O7
  • Average mass436.538 Da
  • Monoisotopic mass436.246094 Da
  • ChemSpider ID21179262

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3R,4aS,5S,6S,6aS,10S,10aS,10bR)-10-Hydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromen-5,6-diyl-diacetat [German] [ACD/IUPAC Name]
(3R,4aS,5S,6S,6aS,10S,10aS,10bR)-10-Hydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyldodecahydro-1H-benzo[f]chromene-5,6-diyl diacetate [ACD/IUPAC Name]
1H-Naphtho[2,1-b]pyran-1-one, 5,6-bis(acetyloxy)-3-ethenyldodecahydro-10-hydroxy-3,4a,7,7,10a-pentamethyl-, (3R,4aS,5S,6S,6aS,10S,10aS,10bR)- [ACD/Index Name]
Diacétate de (3R,4aS,5S,6S,6aS,10S,10aS,10bR)-10-hydroxy-3,4a,7,7,10a-pentaméthyl-1-oxo-3-vinyldodécahydro-1H-benzo[f]chromène-5,6-diyle [French] [ACD/IUPAC Name]
473981-11-2 [RN]
Forskolin G

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

Density: 1.2±0.1 g/cm3
Boiling Point: 503.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.9±6.0 kJ/mol
Flash Point: 160.0±23.6 °C
Index of Refraction: 1.524
Molar Refractivity: 113.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 419.17
ACD/KOC (pH 5.5): 2622.48
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 419.17
ACD/KOC (pH 7.4): 2622.48
Polar Surface Area: 99 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 44.4±5.0 dyne/cm
Molar Volume: 372.0±5.0 cm3

Click to predict properties on the Chemicalize site


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