ChemSpider 2D Image | (3beta,5beta,8xi,9xi)-3-[(6-Deoxy-alpha-D-glycero-hexopyranosyl)oxy]-5,11,14,19-tetrahydroxycard-20(22)-enolide | C29H44O11

(3β,5β,8ξ,9ξ)-3-[(6-Deoxy-α-D-glycero-hexopyranosyl)oxy]-5,11,14,19-tetrahydroxycard-20(22)-enolide

  • Molecular FormulaC29H44O11
  • Average mass568.653 Da
  • Monoisotopic mass568.288391 Da
  • ChemSpider ID21810

  • defined stereocentres - 8 of 14 defined stereocentres

More details:

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

(3β,5β,8ξ,9ξ)-3-[(6-Deoxy-α-D-glycero-hexopyranosyl)oxy]-5,11,14,19-tetrahydroxycard-20(22)-enolide [ACD/IUPAC Name]
(3β,5β,8ξ,9ξ)-3-[(6-Desoxy-α-D-glycero-hexopyranosyl)oxy]-5,11,14,19-tetrahydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
(3β,5β,8ξ,9ξ)-3-[(6-Désoxy-α-D-glycéro-hexopyranosyl)oxy]-5,11,14,19-tétrahydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(6-deoxy-α-D-glycero-hexopyranosyl)oxy]-5,11,14,19-tetrahydroxy-, (3β,5β,8ξ,9ξ)- [ACD/Index Name]
3-β-((L-Rhamnopyranosyl)oxy)-5,11,14,19-tetrahydroxy-5-β-card-20(22)-enolide
5-β-CARD-20(22)-ENOLIDE, 3-β-((L-RHAMNOPYRANOSYL)OXY)-5,11,14,19-TETRAHYDR
5-β-Card-20(22)-enolide, 3-β-((L-rhamnopyranosyl)oxy)-5,11,14,19-tetrahydroxy-
6891-94-7 [RN]
Sarhamnolosid [German]
Sarmentologenin-L-rhamnosid [German]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 801.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.4 mmHg at 25°C
Enthalpy of Vaporization: 132.7±6.0 kJ/mol
Flash Point: 261.0±27.8 °C
Index of Refraction: 1.642
Molar Refractivity: 139.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: -0.73
ACD/LogD (pH 5.5): -0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.79
ACD/LogD (pH 7.4): -0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.79
Polar Surface Area: 186 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 77.8±5.0 dyne/cm
Molar Volume: 386.9±5.0 cm3

Click to predict properties on the Chemicalize site


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