ChemSpider 2D Image | Eucommin A | C27H34O12

Eucommin A

  • Molecular FormulaC27H34O12
  • Average mass550.552 Da
  • Monoisotopic mass550.205017 Da
  • ChemSpider ID391153

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenyl β-D-glucopyranoside [ACD/IUPAC Name]
4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
99633-12-2 [RN]
Eucommin A
β-D-Glucopyranoside de 4-[(1S,3aR,4S,6aR)-4-(4-hydroxy-3-méthoxyphényl)tétrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-diméthoxyphényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2,6-dimethoxy-4-[(1S,3aR,4S,6aR)-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-1H,3H-furo[3,4-c]furan-1-yl]phenyl [ACD/Index Name]
Medioresinol 4'-O-β-D-glucopyranoside

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

C10560 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 764.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.8±3.0 kJ/mol
Flash Point: 416.0±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 135.4±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -1.19
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.26
ACD/LogD (pH 7.4): -0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.21
Polar Surface Area: 166 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 390.9±3.0 cm3

Click to predict properties on the Chemicalize site


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