ChemSpider 2D Image | 7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 6-O-acetyl-4-O-(6-deoxy-L-mannopyranosyl)-beta-D-glucopyranoside | C29H32O15

7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 6-O-acetyl-4-O-(6-deoxy-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC29H32O15
  • Average mass620.555 Da
  • Monoisotopic mass620.174133 Da
  • ChemSpider ID30208553

  • defined stereocentres - 9 of 10 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 5-[[6-O-acetyl-4-O-(6-deoxy-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-7-hydroxy-2-(4-hydroxyphenyl)- [ACD/Index Name]
6-O-Acétyl-4-O-(6-désoxy-L-mannopyranosyl)-β-D-glucopyranoside de 7-hydroxy-2-(4-hydroxyphényl)-4-oxo-4H-chromén-5-yle [French] [ACD/IUPAC Name]
7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 6-O-acetyl-4-O-(6-deoxy-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl-6-O-acetyl-4-O-(6-desoxy-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Camellianin A

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 923.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 140.6±3.0 kJ/mol
    Flash Point: 302.2±27.8 °C
    Index of Refraction: 1.693
    Molar Refractivity: 144.9±0.4 cm3
    #H bond acceptors: 15
    #H bond donors: 7
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 3
    ACD/LogP: 2.20
    ACD/LogD (pH 5.5): 0.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 26.08
    ACD/LogD (pH 7.4): -0.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.77
    Polar Surface Area: 231 Å2
    Polarizability: 57.5±0.5 10-24cm3
    Surface Tension: 94.4±5.0 dyne/cm
    Molar Volume: 377.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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