ChemSpider 2D Image | rathbunioside R2 | C32H56O9

rathbunioside R2

  • Molecular FormulaC32H56O9
  • Average mass584.782 Da
  • Monoisotopic mass584.392456 Da
  • ChemSpider ID9072464

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(3β,5α,6β,15α,24S)-3,5,6,15-Tetrahydroxycholestan-24-yl β-D-xylopyranoside [ACD/IUPAC Name]
(3β,5α,6β,15α,24S)-3,5,6,15-Tetrahydroxycholestan-24-yl-β-D-xylopyranosid [German] [ACD/IUPAC Name]
rathbunioside R2
β-D-Xylopyranoside de (3β,5α,6β,15α,24S)-3,5,6,15-tétrahydroxycholestan-24-yle [French] [ACD/IUPAC Name]
β-D-Xylopyranoside, (3β,5α,6β,15α,24S)-3,5,6,15-tetrahydroxycholestan-24-yl [ACD/Index Name]
24(S)-24-O-(β-D-xylopyranosyl)-5α-cholestane-3β,5,6β,15α,24-pentaol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 713.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.2±6.0 kJ/mol
Flash Point: 385.6±32.9 °C
Index of Refraction: 1.584
Molar Refractivity: 154.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.38
ACD/KOC (pH 5.5): 499.89
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.38
ACD/KOC (pH 7.4): 499.89
Polar Surface Area: 160 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 460.0±5.0 cm3

Click to predict properties on the Chemicalize site


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