ChemSpider 2D Image | (3beta)-3-{[2-O-(beta-D-Galactopyranosyl)-alpha-L-arabinopyranosyl]oxy}-24-oxolanosta-8,25-dien-30-oic acid | C41H64O13

(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}-24-oxolanosta-8,25-dien-30-oic acid

  • Molecular FormulaC41H64O13
  • Average mass764.939 Da
  • Monoisotopic mass764.434692 Da
  • ChemSpider ID17267154

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}-24-oxolanosta-8,25-dien-30-oic acid [ACD/IUPAC Name]
(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}-24-oxolanosta-8,25-dien-30-säure [German] [ACD/IUPAC Name]
Acide (3β)-3-{[2-O-(β-D-galactopyranosyl)-α-L-arabinopyranosyl]oxy}-24-oxolanosta-8,25-dién-30-oïque [French] [ACD/IUPAC Name]
Lanosta-8,25-dien-30-oic acid, 3-[(2-O-β-D-galactopyranosyl-α-L-arabinopyranosyl)oxy]-24-oxo-, (3β)- [ACD/Index Name]
3β-O[β-D-galactopyranosyl-(1-->2)-α-L-arabinopyranosyl]-14-carboxy3α-hydroxy-lanosta-8,25-diene-24-one
eryloside F4

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

Density: 1.3±0.1 g/cm3
Boiling Point: 886.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 146.3±6.0 kJ/mol
Flash Point: 262.2±27.8 °C
Index of Refraction: 1.594
Molar Refractivity: 196.3±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 30.90
ACD/KOC (pH 5.5): 208.33
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.28
Polar Surface Area: 213 Å2
Polarizability: 77.8±0.5 10-24cm3
Surface Tension: 63.1±5.0 dyne/cm
Molar Volume: 578.5±5.0 cm3

Click to predict properties on the Chemicalize site


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