ChemSpider 2D Image | (3beta,5alpha,17beta)-20-Hydroxy-6-oxocevan-3-yl alpha-D-glucopyranoside | C33H53NO8

(3β,5α,17β)-20-Hydroxy-6-oxocevan-3-yl α-D-glucopyranoside

  • Molecular FormulaC33H53NO8
  • Average mass591.776 Da
  • Monoisotopic mass591.377136 Da
  • ChemSpider ID17466611

  • defined stereocentres - 17 of 17 defined stereocentres

More details:

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

(3β,5α,17β)-20-Hydroxy-6-oxocevan-3-yl α-D-glucopyranoside [ACD/IUPAC Name]
(3β,5α,17β)-20-Hydroxy-6-oxocevan-3-yl-α-D-glucopyranosid [German] [ACD/IUPAC Name]
Cevan-6-one, 3-(α-D-glucopyranosyloxy)-20-hydroxy-, (3β,5α,17β)- [ACD/Index Name]
α-D-Glucopyranoside de (3β,5α,17β)-20-hydroxy-6-oxocévan-3-yle [French] [ACD/IUPAC Name]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 742.7±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±5.6 mmHg at 25°C
    Enthalpy of Vaporization: 123.6±6.0 kJ/mol
    Flash Point: 403.0±32.9 °C
    Index of Refraction: 1.612
    Molar Refractivity: 155.4±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 2
    ACD/LogP: 1.85
    ACD/LogD (pH 5.5): -0.95
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.03
    Polar Surface Area: 140 Å2
    Polarizability: 61.6±0.5 10-24cm3
    Surface Tension: 64.0±5.0 dyne/cm
    Molar Volume: 447.2±5.0 cm3

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