ChemSpider 2D Image | Musaroside | C30H44O10

Musaroside

  • Molecular FormulaC30H44O10
  • Average mass564.664 Da
  • Monoisotopic mass564.293457 Da
  • ChemSpider ID390442

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(3β,5β,12β)-3-[(6-Deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-12,14-dihydroxy-11-oxocard-20(22)-enolide [ACD/IUPAC Name]
(3β,5β,12β)-3-[(6-Desoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-12,14-dihydroxy-11-oxocard-20(22)-enolid [German] [ACD/IUPAC Name]
(3β,5β,12β)-3-[(6-Désoxy-3-O-méthyl-β-D-galactopyranosyl)oxy]-12,14-dihydroxy-11-oxocard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(6-deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-12,14-dihydroxy-11-oxo-, (3β,5β,12β)- [ACD/Index Name]
Musaroside
465-97-4 [RN]
Sarmutogenin 3-O-β-D-digitaloside

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

C08875 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 769.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.7±6.0 kJ/mol
Flash Point: 248.8±26.4 °C
Index of Refraction: 1.599
Molar Refractivity: 141.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.92
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.42
ACD/KOC (pH 5.5): 44.84
ACD/LogD (pH 7.4): 0.50
ACD/BCF (pH 7.4): 1.42
ACD/KOC (pH 7.4): 44.84
Polar Surface Area: 152 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 62.6±5.0 dyne/cm
Molar Volume: 414.2±5.0 cm3

Click to predict properties on the Chemicalize site


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