ChemSpider 2D Image | (7beta,12alpha,24E)-12-Acetoxy-7,28-dihydroxy-3,11,15-trioxolanosta-8,24-dien-26-oic acid | C32H44O9

(7β,12α,24E)-12-Acetoxy-7,28-dihydroxy-3,11,15-trioxolanosta-8,24-dien-26-oic acid

  • Molecular FormulaC32H44O9
  • Average mass572.686 Da
  • Monoisotopic mass572.298523 Da
  • ChemSpider ID59003730

  • 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)-12-Acetoxy-7,28-dihydroxy-3,11,15-trioxolanosta-8,24-dien-26-oic acid [ACD/IUPAC Name]
(7β,12α,24E)-12-Acetoxy-7,28-dihydroxy-3,11,15-trioxolanosta-8,24-dien-26-säure [German] [ACD/IUPAC Name]
Acide (7β,12α,24E)-12-acétoxy-7,28-dihydroxy-3,11,15-trioxolanosta-8,24-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-26-oic acid, 12-(acetyloxy)-7,28-dihydroxy-3,11,15-trioxo-, (7β,12α,24E)- [ACD/Index Name]
Ganoleuconin D

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

Density: 1.3±0.1 g/cm3
Boiling Point: 742.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 123.6±6.0 kJ/mol
Flash Point: 234.5±26.4 °C
Index of Refraction: 1.574
Molar Refractivity: 148.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 22.19
ACD/KOC (pH 5.5): 213.30
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.67
Polar Surface Area: 155 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 448.9±5.0 cm3

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