ChemSpider 2D Image | Isorhamnetin 3-O-galactoside | C22H22O12

Isorhamnetin 3-O-galactoside

  • Molecular FormulaC22H22O12
  • Average mass478.403 Da
  • Monoisotopic mass478.111115 Da
  • ChemSpider ID29364577

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(β-D-mannopyranosyloxy)- [ACD/Index Name]
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl β-D-mannopyranoside [ACD/IUPAC Name]
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl-β-D-mannopyranosid [German] [ACD/IUPAC Name]
6743-92-6 [RN]
Isorhamnetin 3-O-galactoside
β-D-Mannopyranoside de 5,7-dihydroxy-2-(4-hydroxy-3-méthoxyphényl)-4-oxo-4H-chromén-3-yle [French] [ACD/IUPAC Name]
[6743-92-6] [RN]
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(((2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
5,7-Dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-o
Isorhamnetin-3-O-galactopyranoside
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.8±0.1 g/cm3
    Boiling Point: 834.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.2 mmHg at 25°C
    Enthalpy of Vaporization: 127.1±3.0 kJ/mol
    Flash Point: 291.3±27.8 °C
    Index of Refraction: 1.750
    Molar Refractivity: 110.8±0.4 cm3
    #H bond acceptors: 12
    #H bond donors: 7
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 2
    ACD/LogP: 1.71
    ACD/LogD (pH 5.5): 0.55
    ACD/BCF (pH 5.5): 1.44
    ACD/KOC (pH 5.5): 41.72
    ACD/LogD (pH 7.4): -0.97
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.25
    Polar Surface Area: 196 Å2
    Polarizability: 43.9±0.5 10-24cm3
    Surface Tension: 112.5±5.0 dyne/cm
    Molar Volume: 272.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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