ChemSpider 2D Image | Miconioside A | C29H36O14

Miconioside A

  • Molecular FormulaC29H36O14
  • Average mass608.588 Da
  • Monoisotopic mass608.210510 Da
  • ChemSpider ID9225480

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2S)-5-Hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-α-L-arabinopyranosyl-β-D-glucopyranoside [ACD/IUPAC Name]
(2S)-5-Hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl-6-O-α-L-arabinopyranosyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 7-[(6-O-α-L-arabinopyranosyl-β-D-glucopyranosyl)oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-, (2S)- [ACD/Index Name]
6-O-α-L-Arabinopyranosyl-β-D-glucopyranoside de (2S)-5-hydroxy-2-(4-méthoxyphényl)-6,8-diméthyl-4-oxo-3,4-dihydro-2H-chromén-7-yle [French] [ACD/IUPAC Name]
Miconioside A
5,7-Dihydroxy-4'-methoxy-6,8-di-C-methylflavanone 7-O-α-L-arabinopyranosyl-(1->6)-β-D-glucopyranoside
Matteucinol 7-O-α-L-arabinopyranosyl(1->6)-β-D-glucopyranoside

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

Density: 1.6±0.1 g/cm3
Boiling Point: 907.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.3±3.0 kJ/mol
Flash Point: 296.6±27.8 °C
Index of Refraction: 1.673
Molar Refractivity: 145.1±0.4 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.52
ACD/KOC (pH 5.5): 133.00
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 4.72
ACD/KOC (pH 7.4): 96.20
Polar Surface Area: 214 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 87.9±5.0 dyne/cm
Molar Volume: 387.1±5.0 cm3

Click to predict properties on the Chemicalize site


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