ChemSpider 2D Image | oleuropein 6-O-beta-D-glucopyranoside | C25H32O13

oleuropein 6-O-β-D-glucopyranoside

  • Molecular FormulaC25H32O13
  • Average mass540.514 Da
  • Monoisotopic mass540.184265 Da
  • ChemSpider ID35518208
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 7 defined stereocentres


More details:






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

[(3E)-5-Acétoxy-3-éthylidène-2-(β-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-4-yl]acétate de 2-(3,4-dihydroxyphényl)éthyle [French] [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)ethyl [(3E)-5-acetoxy-3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-4-yl]acetate [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)ethyl-[(3E)-5-acetoxy-3-ethyliden-2-(β-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-4-yl]acetat [German] [ACD/IUPAC Name]
2H-Pyran-4-acetic acid, 5-(acetyloxy)-3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-, 2-(3,4-dihydroxyphenyl)ethyl ester, (3E)- [ACD/Index Name]
oleuropein 6-O-β-D-glucopyranoside
2H-pyran-4-acetic acid, 3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-, 2-(3,4-dihydroxyphenyl)ethyl ester

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

Density: 1.5±0.1 g/cm3
Boiling Point: 779.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.0±3.0 kJ/mol
Flash Point: 259.5±26.4 °C
Index of Refraction: 1.630
Molar Refractivity: 128.0±0.4 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -0.23
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.27
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.14
Polar Surface Area: 202 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 78.2±5.0 dyne/cm
Molar Volume: 359.8±5.0 cm3

Click to predict properties on the Chemicalize site






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