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Search term: QNTLAUONRLYCLG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-Methoxy-17-[(2-O-methyl-beta-D-glucopyranosyl)oxy]-23-oxotetracosanoic acid | C32H60O10

3-Methoxy-17-[(2-O-methyl-β-D-glucopyranosyl)oxy]-23-oxotetracosanoic acid

  • Molecular FormulaC32H60O10
  • Average mass604.813 Da
  • Monoisotopic mass604.418640 Da
  • ChemSpider ID8275720

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

3-Methoxy-17-[(2-O-methyl-β-D-glucopyranosyl)oxy]-23-oxotetracosanoic acid [ACD/IUPAC Name]
3-Methoxy-17-[(2-O-methyl-β-D-glucopyranosyl)oxy]-23-oxotetracosansäure [German] [ACD/IUPAC Name]
Acide 3-méthoxy-17-[(2-O-méthyl-β-D-glucopyranosyl)oxy]-23-oxotétracosanoïque [French] [ACD/IUPAC Name]
Tetracosanoic acid, 3-methoxy-17-[(2-O-methyl-β-D-glucopyranosyl)oxy]-23-oxo- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 740.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 123.3±6.0 kJ/mol
Flash Point: 223.6±26.4 °C
Index of Refraction: 1.506
Molar Refractivity: 161.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 27
#Rule of 5 Violations: 3
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 4.33
ACD/BCF (pH 5.5): 576.93
ACD/KOC (pH 5.5): 1459.04
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 9.48
ACD/KOC (pH 7.4): 23.96
Polar Surface Area: 152 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 543.4±5.0 cm3

Click to predict properties on the Chemicalize site


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