ChemSpider 2D Image | Tenuifoliside B | C30H36O17

Tenuifoliside B

  • Molecular FormulaC30H36O17
  • Average mass668.597 Da
  • Monoisotopic mass668.195251 Da
  • ChemSpider ID8230775

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

139726-36-6 [RN]
3-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]-β-D-fructofuranosyl 6-O-(4-hydroxybenzoyl)-α-D-glucopyranoside [ACD/IUPAC Name]
3-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]-β-D-fructofuranosyl-6-O-(4-hydroxybenzoyl)-α-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-(4-Hydroxybenzoyl)-α-D-glucopyranoside de 3-O-[(2E)-3-(4-hydroxy-3,5-diméthoxyphényl)-2-propenoyl]-β-D-fructofuranosyle [French] [ACD/IUPAC Name]
Tenuifoliside B
α-D-Glucopyranoside, 3-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]-β-D-fructofuranosyl, 6-(4-hydroxybenzoate) [ACD/Index Name]
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2S,3S,4R,5R)-4-hydroxy-3-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl 4-hydroxybenzoate
MFCD00915287
tenuifolisideb

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

F38VD25Q1W [DBID]
UNII:F38VD25Q1W [DBID]
UNII-F38VD25Q1W [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 926.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 141.1±3.0 kJ/mol
    Flash Point: 296.8±27.8 °C
    Index of Refraction: 1.670
    Molar Refractivity: 155.2±0.4 cm3
    #H bond acceptors: 17
    #H bond donors: 8
    #Freely Rotating Bonds: 14
    #Rule of 5 Violations: 3
    ACD/LogP: 3.19
    ACD/LogD (pH 5.5): 1.30
    ACD/BCF (pH 5.5): 5.70
    ACD/KOC (pH 5.5): 120.82
    ACD/LogD (pH 7.4): 1.22
    ACD/BCF (pH 7.4): 4.78
    ACD/KOC (pH 7.4): 101.39
    Polar Surface Area: 261 Å2
    Polarizability: 61.5±0.5 10-24cm3
    Surface Tension: 92.9±5.0 dyne/cm
    Molar Volume: 415.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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