ChemSpider 2D Image | 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide | C30H44O9

3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide

  • Molecular FormulaC30H44O9
  • Average mass548.665 Da
  • Monoisotopic mass548.298523 Da
  • ChemSpider ID4587

More details:

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

1182-87-2 [RN]
214-659-9 [EINECS]
3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolide [ACD/IUPAC Name]
3-[(6-Desoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-enolid [German] [ACD/IUPAC Name]
3-[(6-Désoxy-3-O-méthylhexopyranosyl)oxy]-14-hydroxy-19-oxocard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(6-deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-19-oxo- [ACD/Index Name]
Peruvoside [Wiki]
Peruvoside from Thevetia neriifolia

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

P7897_SIGMA [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 731.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.9±6.0 kJ/mol
Flash Point: 236.2±26.4 °C
Index of Refraction: 1.588
Molar Refractivity: 140.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 4.97
ACD/KOC (pH 5.5): 109.73
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.97
ACD/KOC (pH 7.4): 109.73
Polar Surface Area: 132 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 416.5±5.0 cm3

Click to predict properties on the Chemicalize site


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