ChemSpider 2D Image | (3beta,24xi)-Stigmast-5-en-3-yl beta-D-glucopyranoside | C35H60O6

(3β,24ξ)-Stigmast-5-en-3-yl β-D-glucopyranoside

  • Molecular FormulaC35H60O6
  • Average mass576.847 Da
  • Monoisotopic mass576.438965 Da
  • ChemSpider ID67166070

  • defined stereocentres - 13 of 14 defined stereocentres

More details:

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

(3β,24ξ)-Stigmast-5-en-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,24ξ)-Stigmast-5-en-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de (3β,24ξ)-stigmast-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,24ξ)-stigmast-5-en-3-yl [ACD/Index Name]
??-sitosterol-3-O-??-d-glucoside

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

Density: 1.1±0.1 g/cm3
Boiling Point: 673.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.2±6.0 kJ/mol
Flash Point: 361.2±31.5 °C
Index of Refraction: 1.554
Molar Refractivity: 162.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.78
ACD/LogD (pH 5.5): 7.18
ACD/BCF (pH 5.5): 168582.45
ACD/KOC (pH 5.5): 191835.48
ACD/LogD (pH 7.4): 7.18
ACD/BCF (pH 7.4): 168581.34
ACD/KOC (pH 7.4): 191834.22
Polar Surface Area: 99 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 48.6±5.0 dyne/cm
Molar Volume: 508.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement