ChemSpider 2D Image | (3aS,12aR)-4,6-Dihydroxy-5,10-dioxo-2,3,3a,5,10,12a-hexahydroanthra[2,3-b]furo[3,2-d]furan-8-yl beta-D-galactofuranoside | C24H22O12

(3aS,12aR)-4,6-Dihydroxy-5,10-dioxo-2,3,3a,5,10,12a-hexahydroanthra[2,3-b]furo[3,2-d]furan-8-yl β-D-galactofuranoside

  • Molecular FormulaC24H22O12
  • Average mass502.424 Da
  • Monoisotopic mass502.111115 Da
  • ChemSpider ID58989078

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3aS,12aR)-4,6-Dihydroxy-5,10-dioxo-2,3,3a,5,10,12a-hexahydroanthra[2,3-b]furo[3,2-d]furan-8-yl β-D-galactofuranoside [ACD/IUPAC Name]
(3aS,12aR)-4,6-Dihydroxy-5,10-dioxo-2,3,3a,5,10,12a-hexahydroanthra[2,3-b]furo[3,2-d]furan-8-yl-β-D-galactofuranosid [German] [ACD/IUPAC Name]
Anthra[2,3-b]furo[3,2-d]furan-5,10-dione, 8-(β-D-galactofuranosyloxy)-2,3,3a,12a-tetrahydro-4,6-dihydroxy-, (3aS,12aR)- [ACD/Index Name]
β-D-Galactofuranoside de (3aS,12aR)-4,6-dihydroxy-5,10-dioxo-2,3,3a,5,10,12a-hexahydroanthra[2,3-b]furo[3,2-d]furan-8-yle [French] [ACD/IUPAC Name]
Quinofuracin E

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

Density: 1.8±0.1 g/cm3
Boiling Point: 848.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 129.1±3.0 kJ/mol
Flash Point: 294.7±27.8 °C
Index of Refraction: 1.747
Molar Refractivity: 116.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.28
ACD/KOC (pH 5.5): 52.78
ACD/LogD (pH 7.4): -1.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 192 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 101.7±3.0 dyne/cm
Molar Volume: 285.7±3.0 cm3

Click to predict properties on the Chemicalize site


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