ChemSpider 2D Image | Sarcostin | C21H34O6

Sarcostin

  • Molecular FormulaC21H34O6
  • Average mass382.491 Da
  • Monoisotopic mass382.235535 Da
  • ChemSpider ID30791575

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,12β,14β,17α,20S)-Pregn-5-en-3,8,12,14,17,20-hexol [German] [ACD/IUPAC Name]
(3β,12β,14β,17α,20S)-Pregn-5-ene-3,8,12,14,17,20-hexol [ACD/IUPAC Name]
(3β,12β,14β,17α,20S)-Prégn-5-ène-3,8,12,14,17,20-hexol [French] [ACD/IUPAC Name]
18607-76-6 [RN]
Pregn-5-ene-3,8,12,14,17,20-hexol, (3β,12β,14β,17α,20S)- [ACD/Index Name]
Sarcostin
(3S,8S,9R,10R,12R,13R,14R,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthrene-3,8,12,14,17-pentol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 572.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.5±6.0 kJ/mol
Flash Point: 258.5±24.7 °C
Index of Refraction: 1.631
Molar Refractivity: 100.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 0.68
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.47
ACD/KOC (pH 5.5): 66.50
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 2.47
ACD/KOC (pH 7.4): 66.50
Polar Surface Area: 121 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 70.5±5.0 dyne/cm
Molar Volume: 280.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement