ChemSpider 2D Image | 3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide | C30H46O9

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide

  • Molecular FormulaC30H46O9
  • Average mass550.681 Da
  • Monoisotopic mass550.314209 Da
  • ChemSpider ID499673

More details:

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

3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide [ACD/IUPAC Name]
3-[(2,6-Didesoxy-3-O-methylhexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
3-[(2,6-Didésoxy-3-O-méthylhexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(2,6-dideoxy-3-O-methylhexopyranosyl)oxy]-5,14,19-trihydroxy- [ACD/Index Name]
3-β-(β-D-Cymarosyloxy)-5,14,19-trihydroxy-5-β-card-20(22)-enolide
Card-20(22)-enolide, 3-[(2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl)oxy]-5,14,19-trihydroxy-, (3β,5β)-
Cymarol
Strophandiol-D-cymarosid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 730.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.7±6.0 kJ/mol
Flash Point: 234.9±26.4 °C
Index of Refraction: 1.596
Molar Refractivity: 141.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.39
ACD/LogD (pH 5.5): 0.48
ACD/BCF (pH 5.5): 1.36
ACD/KOC (pH 5.5): 43.46
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.36
ACD/KOC (pH 7.4): 43.46
Polar Surface Area: 135 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 60.9±5.0 dyne/cm
Molar Volume: 416.0±5.0 cm3

Click to predict properties on the Chemicalize site


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