ChemSpider 2D Image | (3beta,6alpha,9beta,16beta,24R)-3-{[2-O-(alpha-L-Arabinopyranosyl)-beta-D-xylopyranosyl]oxy}-6,24,25-trihydroxy-9,19-cyclolanostan-16-yl beta-L-glucopyranoside | C46H78O18

(3β,6α,9β,16β,24R)-3-{[2-O-(α-L-Arabinopyranosyl)-β-D-xylopyranosyl]oxy}-6,24,25-trihydroxy-9,19-cyclolanostan-16-yl β-L-glucopyranoside

  • Molecular FormulaC46H78O18
  • Average mass919.101 Da
  • Monoisotopic mass918.518799 Da
  • ChemSpider ID30847747

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

(3β,6α,9β,16β,24R)-3-{[2-O-(α-L-Arabinopyranosyl)-β-D-xylopyranosyl]oxy}-6,24,25-trihydroxy-9,19-cyclolanostan-16-yl β-L-glucopyranoside [ACD/IUPAC Name]
(3β,6α,9β,16β,24R)-3-{[2-O-(α-L-Arabinopyranosyl)-β-D-xylopyranosyl]oxy}-6,24,25-trihydroxy-9,19-cyclolanostan-16-yl-β-L-glucopyranosid [German] [ACD/IUPAC Name]
β-L-Glucopyranoside de (3β,6α,9β,16β,24R)-3-{[2-O-(α-L-arabinopyranosyl)-β-D-xylopyranosyl]oxy}-6,24,25-trihydroxy-9,19-cyclolanostan-16-yle [French] [ACD/IUPAC Name]
β-L-Glucopyranoside, (3β,6α,9β,16β,24R)-3-[(2-O-α-L-arabinopyranosyl-β-D-xylopyranosyl)oxy]-6,24,25-trihydroxy-9,19-cyclolanostan-16-yl [ACD/Index Name]
Askendoside F

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1023.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 169.3±6.0 kJ/mol
Flash Point: 572.7±34.3 °C
Index of Refraction: 1.625
Molar Refractivity: 227.2±0.4 cm3
#H bond acceptors: 18
#H bond donors: 12
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.86
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.86
Polar Surface Area: 298 Å2
Polarizability: 90.1±0.5 10-24cm3
Surface Tension: 76.3±5.0 dyne/cm
Molar Volume: 642.3±5.0 cm3

Click to predict properties on the Chemicalize site


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