ChemSpider 2D Image | (3beta,7alpha,15alpha)-7-(beta-D-Galactopyranosyloxy)-3,15-dihydroxy-24-methylenelanost-8-en-21-oic acid | C37H60O10

(3β,7α,15α)-7-(β-D-Galactopyranosyloxy)-3,15-dihydroxy-24-methylenelanost-8-en-21-oic acid

  • Molecular FormulaC37H60O10
  • Average mass664.866 Da
  • Monoisotopic mass664.418640 Da
  • ChemSpider ID8827369

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(3β,7α,15α)-7-(β-D-Galactopyranosyloxy)-3,15-dihydroxy-24-methylenelanost-8-en-21-oic acid [ACD/IUPAC Name]
(3β,7α,15α)-7-(β-D-Galactopyranosyloxy)-3,15-dihydroxy-24-methylenlanost-8-en-21-säure [German] [ACD/IUPAC Name]
Acide (3β,7α,15α)-7-(β-D-galactopyranosyloxy)-3,15-dihydroxy-24-méthylènelanost-8-én-21-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-21-oic acid, 7-(β-D-galactopyranosyloxy)-3,15-dihydroxy-24-methylene-, (3β,7α,15α)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 801.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.4 mmHg at 25°C
Enthalpy of Vaporization: 132.7±6.0 kJ/mol
Flash Point: 241.6±27.8 °C
Index of Refraction: 1.587
Molar Refractivity: 176.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 62.52
ACD/KOC (pH 5.5): 358.04
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.63
Polar Surface Area: 177 Å2
Polarizability: 69.9±0.5 10-24cm3
Surface Tension: 59.5±5.0 dyne/cm
Molar Volume: 524.2±5.0 cm3

Click to predict properties on the Chemicalize site


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