ChemSpider 2D Image | (2S)-2-(3-Hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-3,4-dihydro-2H-chromen-5-yl beta-D-glucopyranoside | C23H26O11

(2S)-2-(3-Hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-3,4-dihydro-2H-chromen-5-yl β-D-glucopyranoside

  • Molecular FormulaC23H26O11
  • Average mass478.446 Da
  • Monoisotopic mass478.147522 Da
  • ChemSpider ID33823785

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2S)-2-(3-Hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-3,4-dihydro-2H-chromen-5-yl β-D-glucopyranoside [ACD/IUPAC Name]
(2S)-2-(3-Hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-3,4-dihydro-2H-chromen-5-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
(2S)-5-(β-D-Glucopyranosyloxy)-2,3-dihydro-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
28978-03-2 [RN]
4H-1-Benzopyran-4-one, 5-(β-D-glucopyranosyloxy)-2,3-dihydro-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-, (2S)- [ACD/Index Name]
β-D-Glucopyranoside de (2S)-2-(3-hydroxy-4-méthoxyphényl)-7-méthoxy-4-oxo-3,4-dihydro-2H-chromén-5-yle [French] [ACD/IUPAC Name]
MFCD23103617
Persicoside

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 787.7±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 120.2±3.0 kJ/mol
    Flash Point: 272.3±26.4 °C
    Index of Refraction: 1.638
    Molar Refractivity: 115.6±0.3 cm3
    #H bond acceptors: 11
    #H bond donors: 5
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 0.11
    ACD/LogD (pH 5.5): -0.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 20.74
    ACD/LogD (pH 7.4): -0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 20.62
    Polar Surface Area: 164 Å2
    Polarizability: 45.8±0.5 10-24cm3
    Surface Tension: 70.0±3.0 dyne/cm
    Molar Volume: 321.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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