ChemSpider 2D Image | 10-Hydroxy-5,7-dimethoxy-3-methyl-1-oxo-1H-benzo[g]isochromen-9-yl 6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside | C27H32O15

10-Hydroxy-5,7-dimethoxy-3-methyl-1-oxo-1H-benzo[g]isochromen-9-yl 6-O-α-L-arabinopyranosyl-β-D-glucopyranoside

  • Molecular FormulaC27H32O15
  • Average mass596.534 Da
  • Monoisotopic mass596.174133 Da
  • ChemSpider ID9257696

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

10-Hydroxy-5,7-dimethoxy-3-methyl-1-oxo-1H-benzo[g]isochromen-9-yl 6-O-α-L-arabinopyranosyl-β-D-glucopyranoside [ACD/IUPAC Name]
10-Hydroxy-5,7-dimethoxy-3-methyl-1-oxo-1H-benzo[g]isochromen-9-yl-6-O-α-L-arabinopyranosyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
1H-Naphtho[2,3-c]pyran-1-one, 9-[(6-O-α-L-arabinopyranosyl-β-D-glucopyranosyl)oxy]-10-hydroxy-5,7-dimethoxy-3-methyl- [ACD/Index Name]
6-O-α-L-Arabinopyranosyl-β-D-glucopyranoside de 10-hydroxy-5,7-diméthoxy-3-méthyl-1-oxo-1H-benzo[g]isochromén-9-yle [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL503057/

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

Density: 1.7±0.1 g/cm3
Boiling Point: 935.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 142.6±3.0 kJ/mol
Flash Point: 309.9±27.8 °C
Index of Refraction: 1.701
Molar Refractivity: 139.4±0.4 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 1.24
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.62
ACD/KOC (pH 5.5): 49.04
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.06
ACD/KOC (pH 7.4): 32.17
Polar Surface Area: 223 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 94.7±5.0 dyne/cm
Molar Volume: 360.4±5.0 cm3

Click to predict properties on the Chemicalize site


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