ChemSpider 2D Image | (3beta,22E)-17-Hydroxy-18-oxo-18,20-epoxylanosta-7,9(11),22,24-tetraen-3-yl beta-D-xylopyranoside | C35H50O8

(3β,22E)-17-Hydroxy-18-oxo-18,20-epoxylanosta-7,9(11),22,24-tetraen-3-yl β-D-xylopyranoside

  • Molecular FormulaC35H50O8
  • Average mass598.767 Da
  • Monoisotopic mass598.350586 Da
  • ChemSpider ID29214294

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(3β,22E)-17-Hydroxy-18-oxo-18,20-epoxylanosta-7,9(11),22,24-tetraen-3-yl β-D-xylopyranoside [ACD/IUPAC Name]
(3β,22E)-17-Hydroxy-18-oxo-18,20-epoxylanosta-7,9(11),22,24-tetraen-3-yl-β-D-xylopyranosid [German] [ACD/IUPAC Name]
Lanosta-7,9(11),22,24-tetraen-18-one, 18,20-epoxy-17-hydroxy-3-(β-D-xylopyranosyloxy)-, (3β,22E)- [ACD/Index Name]
β-D-Xylopyranoside de (3β,22E)-17-hydroxy-18-oxo-18,20-époxylanosta-7,9(11),22,24-tétraén-3-yle [French] [ACD/IUPAC Name]
nobiliside A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 739.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 123.1±6.0 kJ/mol
Flash Point: 229.3±26.4 °C
Index of Refraction: 1.607
Molar Refractivity: 162.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 6.52
ACD/LogD (pH 5.5): 5.91
ACD/BCF (pH 5.5): 18416.81
ACD/KOC (pH 5.5): 39321.26
ACD/LogD (pH 7.4): 5.91
ACD/BCF (pH 7.4): 18416.65
ACD/KOC (pH 7.4): 39320.91
Polar Surface Area: 126 Å2
Polarizability: 64.3±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 469.6±5.0 cm3

Click to predict properties on the Chemicalize site


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