ChemSpider 2D Image | (3beta,25R)-14,17-Dihydroxyspirost-5-en-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside | C39H62O14

(3β,25R)-14,17-Dihydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC39H62O14
  • Average mass754.901 Da
  • Monoisotopic mass754.413940 Da
  • ChemSpider ID62960457

  • defined stereocentres - 21 of 21 defined stereocentres

More details:

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

(3β,25R)-14,17-Dihydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,25R)-14,17-Dihydroxyspirost-5-en-3-yl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
128502-94-3 [RN]
2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de (3β,25R)-14,17-dihydroxyspirost-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,25R)-14,17-dihydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)- [ACD/Index Name]
DGFVATVOFRGGFO-IPRUERMDSA-N

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

Density: 1.4±0.1 g/cm3
Boiling Point: 900.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 148.6±6.0 kJ/mol
Flash Point: 498.4±34.3 °C
Index of Refraction: 1.627
Molar Refractivity: 188.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 4.77
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 223.05
ACD/KOC (pH 5.5): 1669.51
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 223.04
ACD/KOC (pH 7.4): 1669.49
Polar Surface Area: 217 Å2
Polarizability: 74.7±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 531.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement