ChemSpider 2D Image | 2,3,14,20,22-Pentahydroxy-26,28-epoxystigmast-7-ene-6,26-dione | C29H44O8

2,3,14,20,22-Pentahydroxy-26,28-epoxystigmast-7-ene-6,26-dione

  • Molecular FormulaC29H44O8
  • Average mass520.655 Da
  • Monoisotopic mass520.303589 Da
  • ChemSpider ID481922

More details:

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

2,3,14,20,22-Pentahydroxy-26,28-epoxystigmast-7-en-6,26-dion [German] [ACD/IUPAC Name]
2,3,14,20,22-Pentahydroxy-26,28-epoxystigmast-7-ene-6,26-dione [ACD/IUPAC Name]
2,3,14,20,22-Pentahydroxy-26,28-époxystigmast-7-ène-6,26-dione [French] [ACD/IUPAC Name]
Stigmast-7-ene-6,26-dione, 26,28-epoxy-2,3,14,20,22-pentahydroxy- [ACD/Index Name]
17086-76-9 [RN]
5β-Stigmast-7-en-26-oic acid, 2β,3β,14,20,22,28-hexahydroxy-6-oxo-, γ-lactone, (22R,24S,25S,28R)-
Cyasteron
cyasterone
Stigmast-7-en-26-oic acid, 2,3,14,20,22,28-hexahydroxy-6-oxo-, γ-lactone, (2β,3β,5β,22R,24S,25S,28R)-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 735.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.5±6.0 kJ/mol
Flash Point: 239.2±26.4 °C
Index of Refraction: 1.600
Molar Refractivity: 135.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -0.63
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.28
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.28
Polar Surface Area: 145 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 62.2±5.0 dyne/cm
Molar Volume: 395.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement