ChemSpider 2D Image | (3alpha,5alpha,6beta,7beta,16alpha)-3,6-Dihydroxy-7-[(6-O-methyl-beta-D-galactofuranosyl)oxy]cholest-8(14)-en-16-yl 3-O-methyl-beta-D-galactopyranoside | C41H70O14

(3α,5α,6β,7β,16α)-3,6-Dihydroxy-7-[(6-O-methyl-β-D-galactofuranosyl)oxy]cholest-8(14)-en-16-yl 3-O-methyl-β-D-galactopyranoside

  • Molecular FormulaC41H70O14
  • Average mass786.986 Da
  • Monoisotopic mass786.476563 Da
  • ChemSpider ID58197367

  • defined stereocentres - 20 of 20 defined stereocentres

More details:

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

(3α,5α,6β,7β,16α)-3,6-Dihydroxy-7-[(6-O-methyl-β-D-galactofuranosyl)oxy]cholest-8(14)-en-16-yl 3-O-methyl-β-D-galactopyranoside [ACD/IUPAC Name]
(3α,5α,6β,7β,16α)-3,6-Dihydroxy-7-[(6-O-methyl-β-D-galactofuranosyl)oxy]cholest-8(14)-en-16-yl-3-O-methyl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
3-O-Méthyl-β-D-galactopyranoside de (3α,5α,6β,7β,16α)-3,6-dihydroxy-7-[(6-O-méthyl-β-D-galactofuranosyl)oxy]cholest-8(14)-én-16-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (3α,5α,6β,7β,16α)-3,6-dihydroxy-7-[(6-O-methyl-β-D-galactofuranosyl)oxy]cholest-8(14)-en-16-yl 3-O-methyl- [ACD/Index Name]
7-O-(6-O-methyl-β-D-galactofuranosyl)-16-O-(3-O-methyl-β-D-galactopyranosyl)-cholest-8(14)-en-3α,6β,7β,16αtetrol
Hesperuside B

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

Density: 1.3±0.1 g/cm3
Boiling Point: 905.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 149.5±6.0 kJ/mol
Flash Point: 501.7±34.3 °C
Index of Refraction: 1.584
Molar Refractivity: 201.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 4
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1710.07
ACD/KOC (pH 5.5): 7174.46
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1710.06
ACD/KOC (pH 7.4): 7174.39
Polar Surface Area: 217 Å2
Polarizability: 79.8±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 601.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement