ChemSpider 2D Image | (3beta,8xi,9xi,17xi)-3-[(6-Deoxy-beta-L-glycero-hexopyranosyl)oxy]-14-hydroxycarda-5,20(22)-dienolide | C29H42O8

(3β,8ξ,9ξ,17ξ)-3-[(6-Deoxy-β-L-glycero-hexopyranosyl)oxy]-14-hydroxycarda-5,20(22)-dienolide

  • Molecular FormulaC29H42O8
  • Average mass518.639 Da
  • Monoisotopic mass518.287964 Da
  • ChemSpider ID34110

  • defined stereocentres - 6 of 12 defined stereocentres

More details:

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

(3β,8ξ,9ξ,17ξ)-3-[(6-Deoxy-β-L-glycero-hexopyranosyl)oxy]-14-hydroxycarda-5,20(22)-dienolide [ACD/IUPAC Name]
(3β,8ξ,9ξ,17ξ)-3-[(6-Desoxy-β-L-glycero-hexopyranosyl)oxy]-14-hydroxycarda-5,20(22)-dienolid [German] [ACD/IUPAC Name]
(3β,8ξ,9ξ,17ξ)-3-[(6-Désoxy-β-L-glycéro-hexopyranosyl)oxy]-14-hydroxycarda-5,20(22)-diénolide [French] [ACD/IUPAC Name]
Carda-5,20(22)-dienolide, 3-[(6-deoxy-β-L-glycero-hexopyranosyl)oxy]-14-hydroxy-, (3β,8ξ,9ξ,17ξ)- [ACD/Index Name]
35536-76-6 [RN]
Carda-5,20(22)-dienolide, 3-((6-deoxy-α-L-mannopyranosyl)oxy)-14-hydroxy-, (3-β)-
Corchoriside B
Corchorosid B [German]
Corchoroside 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: 706.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.1±6.0 kJ/mol
Flash Point: 230.6±26.4 °C
Index of Refraction: 1.612
Molar Refractivity: 134.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 68.95
ACD/KOC (pH 5.5): 720.50
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 68.95
ACD/KOC (pH 7.4): 720.50
Polar Surface Area: 126 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 62.1±5.0 dyne/cm
Molar Volume: 387.4±5.0 cm3

Click to predict properties on the Chemicalize site


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