ChemSpider 2D Image | (3beta,15alpha)-3-Acetoxy-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid | C32H46O8

(3β,15α)-3-Acetoxy-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid

  • Molecular FormulaC32H46O8
  • Average mass558.703 Da
  • Monoisotopic mass558.319275 Da
  • ChemSpider ID78441213

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(3β,15α)-3-Acetoxy-15-hydroxy-7,11,23-trioxolanost-8-en-26-oic acid [ACD/IUPAC Name]
(3β,15α)-3-Acetoxy-15-hydroxy-7,11,23-trioxolanost-8-en-26-säure [German] [ACD/IUPAC Name]
Acide (3β,15α)-3-acétoxy-15-hydroxy-7,11,23-trioxolanost-8-én-26-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-26-oic acid, 3-(acetyloxy)-15-hydroxy-7,11,23-trioxo-, (3β,15α)- [ACD/Index Name]
3-O-acetylganoderic acid K

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

Density: 1.2±0.1 g/cm3
Boiling Point: 680.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.2±6.0 kJ/mol
Flash Point: 211.7±25.0 °C
Index of Refraction: 1.552
Molar Refractivity: 146.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 102.22
ACD/KOC (pH 5.5): 566.29
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 1.64
ACD/KOC (pH 7.4): 9.08
Polar Surface Area: 135 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 51.1±5.0 dyne/cm
Molar Volume: 459.2±5.0 cm3

Click to predict properties on the Chemicalize site


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