ChemSpider 2D Image | (3beta,5xi,7beta)-3,7,20-Trihydroxy-11,15,23-trioxolanosta-8,16-dien-26-oic acid | C30H42O8

(3β,5ξ,7β)-3,7,20-Trihydroxy-11,15,23-trioxolanosta-8,16-dien-26-oic acid

  • Molecular FormulaC30H42O8
  • Average mass530.650 Da
  • Monoisotopic mass530.287964 Da
  • ChemSpider ID78442398

  • defined stereocentres - 6 of 8 defined stereocentres

More details:

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

(3β,5ξ,7β)-3,7,20-Trihydroxy-11,15,23-trioxolanosta-8,16-dien-26-oic acid [ACD/IUPAC Name]
(3β,5ξ,7β)-3,7,20-Trihydroxy-11,15,23-trioxolanosta-8,16-dien-26-säure [German] [ACD/IUPAC Name]
Acide (3β,5ξ,7β)-3,7,20-trihydroxy-11,15,23-trioxolanosta-8,16-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,16-dien-26-oic acid, 3,7,20-trihydroxy-11,15,23-trioxo-, (3β,5ξ,7β)- [ACD/Index Name]
Resinacein H

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

Density: 1.3±0.1 g/cm3
Boiling Point: 747.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 124.4±6.0 kJ/mol
Flash Point: 419.9±29.4 °C
Index of Refraction: 1.589
Molar Refractivity: 138.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 10.56
ACD/KOC (pH 5.5): 114.14
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.85
Polar Surface Area: 149 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 411.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement