ChemSpider 2D Image | Torachrysone-8-O-β-D-glucopyranoside | C20H24O9

Torachrysone-8-O-β-D-glucopyranoside

  • Molecular FormulaC20H24O9
  • Average mass408.399 Da
  • Monoisotopic mass408.142029 Da
  • ChemSpider ID21542567

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

64032-49-1 [RN]
7-Acetyl-8-hydroxy-3-methoxy-6-methyl-1-naphthyl β-D-glucopyranoside [ACD/IUPAC Name]
7-Acetyl-8-hydroxy-3-methoxy-6-methyl-1-naphthyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
7-acetyl-8-hydroxy-3-methoxy-6-methylnaphthalen-1-yl β-D-glucopyranoside
Ethanone, 1-[8-(β-D-glucopyranosyloxy)-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]- [ACD/Index Name]
Torachrysone-8-O-β-D-glucopyranoside
β-D-Glucopyranoside de 7-acétyl-8-hydroxy-3-méthoxy-6-méthyl-1-naphtyle [French] [ACD/IUPAC Name]
[64032-49-1] [RN]
1-[1-Hydroxy-6-methoxy-3-methyl-8-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-naphthalen-2-yl]-ethanone
7-Acetyl-8-hydroxy-3-methoxy-6-methyl-1-naphthyl?-D-glucopyranoside
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 676.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 104.4±3.0 kJ/mol
    Flash Point: 239.8±25.0 °C
    Index of Refraction: 1.656
    Molar Refractivity: 103.2±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 0.71
    ACD/LogD (pH 5.5): 0.86
    ACD/BCF (pH 5.5): 2.63
    ACD/KOC (pH 5.5): 69.16
    ACD/LogD (pH 7.4): 0.47
    ACD/BCF (pH 7.4): 1.07
    ACD/KOC (pH 7.4): 28.06
    Polar Surface Area: 146 Å2
    Polarizability: 40.9±0.5 10-24cm3
    Surface Tension: 64.4±3.0 dyne/cm
    Molar Volume: 280.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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