ChemSpider 2D Image | 3-{[Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-enolide | C41H64O19

3-{[Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-enolide

  • Molecular FormulaC41H64O19
  • Average mass860.935 Da
  • Monoisotopic mass860.404175 Da
  • ChemSpider ID3029149

More details:

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

3-{[Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-enolide [ACD/IUPAC Name]
3-{[Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2,6-didesoxyhexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
3-{[Hexopyranosyl-(1->4)hexopyranosyl-(1->4)-2,6-didésoxyhexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[[O-hexopyranosyl-(1->4)-O-hexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl]oxy]-5,14,19-trihydroxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 1066.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 176.8±6.0 kJ/mol
Flash Point: 318.1±27.8 °C
Index of Refraction: 1.652
Molar Refractivity: 204.1±0.4 cm3
#H bond acceptors: 19
#H bond donors: 11
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -3.28
ACD/LogD (pH 5.5): -2.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 304 Å2
Polarizability: 80.9±0.5 10-24cm3
Surface Tension: 86.7±5.0 dyne/cm
Molar Volume: 558.4±5.0 cm3

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