ChemSpider 2D Image | CSID:8900143 | C51H84O22

  • Molecular FormulaC51H84O22
  • Average mass1049.199 Da
  • Monoisotopic mass1048.545410 Da
  • ChemSpider ID8900143

  • defined stereocentres - 29 of 29 defined stereocentres

More details:

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

(3β,22R,25R)-26-(β-D-Glucopyranosyloxy)-22-methoxyfurost-5-en-3-yl-4-O-(6-desoxy-α-L-mannopyranosyl)-2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranosi
 d [German] [ACD/IUPAC Name]
4-O-(6-Désoxy-α-L-mannopyranosyl)-2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxyméthyl)tétrahydro-2-furanyl]-β-D-glucopyranoside de (3β,22R,25R)-26-(β-D-glucopyranosyloxy)-22-méthoxyfurost-5-én
 -3-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.625
Molar Refractivity: 254.8±0.4 cm3
#H bond acceptors: 22
#H bond donors: 12
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.51
ACD/KOC (pH 5.5): 235.99
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.51
ACD/KOC (pH 7.4): 235.99
Polar Surface Area: 335 Å2
Polarizability: 101.0±0.5 10-24cm3
Surface Tension: 76.6±5.0 dyne/cm
Molar Volume: 721.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement