ChemSpider 2D Image | CSID:8733704 | C56H92O29

  • Molecular FormulaC56H92O29
  • Average mass1229.312 Da
  • Monoisotopic mass1228.572388 Da
  • ChemSpider ID8733704

  • defined stereocentres - 28 of 36 defined stereocentres

More details:

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

(3β,8ξ,9ξ,14ξ,16ξ,17ξ)-26-(β-D-Glucopyranosyloxy)-22-hydroxy-12-oxofurostan-3-yl-β-D-galactopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-glucopyrano ; sid [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-glucopyranoside de (3β,8ξ,9ξ,14ξ,16ξ,17ξ)-26-(β-D-glucopyranosyloxy)-22-hydroxy-12-oxofurost ; an-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 285.6±0.4 cm3
#H bond acceptors: 29
#H bond donors: 17
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: -3.31
ACD/LogD (pH 5.5): -3.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 463 Å2
Polarizability: 113.2±0.5 10-24cm3
Surface Tension: 92.0±5.0 dyne/cm
Molar Volume: 781.0±5.0 cm3

Click to predict properties on the Chemicalize site


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