ChemSpider 2D Image | (3beta,22E)-3-(beta-D-Arabinopyranosyloxy)-19-hydroxycholesta-5,22-dien-25-yl acetate | C34H54O8

(3β,22E)-3-(β-D-Arabinopyranosyloxy)-19-hydroxycholesta-5,22-dien-25-yl acetate

  • Molecular FormulaC34H54O8
  • Average mass590.788 Da
  • Monoisotopic mass590.381897 Da
  • ChemSpider ID29417261

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 12 of 12 defined stereocentres

More details:

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

(3β,22E)-3-(β-D-Arabinopyranosyloxy)-19-hydroxycholesta-5,22-dien-25-yl acetate [ACD/IUPAC Name]
(3β,22E)-3-(β-D-Arabinopyranosyloxy)-19-hydroxycholesta-5,22-dien-25-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (3β,22E)-3-(β-D-arabinopyranosyloxy)-19-hydroxycholesta-5,22-dién-25-yle [French] [ACD/IUPAC Name]
β-D-Arabinopyranoside, (3β,22E)-25-(acetyloxy)-19-hydroxycholesta-5,22-dien-3-yl [ACD/Index Name]
junceelloside F

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

Density: 1.2±0.1 g/cm3
Boiling Point: 701.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.3±6.0 kJ/mol
Flash Point: 214.3±26.4 °C
Index of Refraction: 1.571
Molar Refractivity: 160.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.54
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4716.16
ACD/KOC (pH 5.5): 14830.23
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4716.14
ACD/KOC (pH 7.4): 14830.15
Polar Surface Area: 126 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 53.7±5.0 dyne/cm
Molar Volume: 487.2±5.0 cm3

Click to predict properties on the Chemicalize site


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