ChemSpider 2D Image | 5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-deoxy-beta-D-mannopyranosyl-(1->2)-[alpha-D-glucopyranosyl-(1->6)]-beta-D-glucopyranoside | C33H40O19

5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-deoxy-β-D-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->6)]-β-D-glucopyranoside

  • Molecular FormulaC33H40O19
  • Average mass740.659 Da
  • Monoisotopic mass740.216370 Da
  • ChemSpider ID71045523
  • defined stereocentres - 15 of 15 defined stereocentres


More details:






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

174284-20-9 [RN]
4H-1-Benzopyran-4-one, 7-[[O-6-deoxy-β-D-mannopyranosyl-(1->2)-O-[α-D-glucopyranosyl-(1->6)]-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)- [ACD/Index Name]
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-deoxy-β-D-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->6)]-β-D-glucopyranoside [ACD/IUPAC Name]
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl-6-desoxy-β-D-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->6)]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-β-D-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->6)]-β-D-glucopyranoside de 5-hydroxy-2-(4-hydroxyphényl)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
Apigenin 7-O-(2G-rhamnosyl)gentiobioside
MFCD29078972

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 1071.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 164.5±3.0 kJ/mol
    Flash Point: 337.9±27.8 °C
    Index of Refraction: 1.729
    Molar Refractivity: 169.1±0.4 cm3
    #H bond acceptors: 19
    #H bond donors: 11
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 3
    ACD/LogP: -0.75
    ACD/LogD (pH 5.5): -1.65
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.73
    ACD/LogD (pH 7.4): -2.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 304 Å2
    Polarizability: 67.0±0.5 10-24cm3
    Surface Tension: 112.8±5.0 dyne/cm
    Molar Volume: 424.1±5.0 cm3

    Click to predict properties on the Chemicalize site






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