ChemSpider 2D Image | (7beta,12alpha,24E)-7,12,28-Trihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid | C30H44O7

(7β,12α,24E)-7,12,28-Trihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid

  • Molecular FormulaC30H44O7
  • Average mass516.666 Da
  • Monoisotopic mass516.308716 Da
  • ChemSpider ID59003596

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(7β,12α,24E)-7,12,28-Trihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid [ACD/IUPAC Name]
(7β,12α,24E)-7,12,28-Trihydroxy-3,11-dioxolanosta-8,24-dien-26-säure [German] [ACD/IUPAC Name]
Acide (7β,12α,24E)-7,12,28-trihydroxy-3,11-dioxolanosta-8,24-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-26-oic acid, 7,12,28-trihydroxy-3,11-dioxo-, (7β,12α,24E)- [ACD/Index Name]
Ganoleuconin B

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

Density: 1.2±0.1 g/cm3
Boiling Point: 709.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.5±6.0 kJ/mol
Flash Point: 396.7±29.4 °C
Index of Refraction: 1.582
Molar Refractivity: 138.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 32.65
ACD/KOC (pH 5.5): 281.98
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.87
Polar Surface Area: 132 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 414.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement