ChemSpider 2D Image | (3S,5Z)-16-Hydroxy-3-methyl-1,11-dioxo-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecin-14-yl beta-L-lyxofuranoside | C23H30O9

(3S,5Z)-16-Hydroxy-3-methyl-1,11-dioxo-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecin-14-yl β-L-lyxofuranoside

  • Molecular FormulaC23H30O9
  • Average mass450.479 Da
  • Monoisotopic mass450.188995 Da
  • ChemSpider ID62565154

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3S,5Z)-16-Hydroxy-3-methyl-1,11-dioxo-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecin-14-yl β-L-lyxofuranoside [ACD/IUPAC Name]
(3S,5Z)-16-Hydroxy-3-methyl-1,11-dioxo-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecin-14-yl-β-L-lyxofuranosid [German] [ACD/IUPAC Name]
1H-2-Benzoxacyclotetradecin-1,11(12H)-dione, 3,4,7,8,9,10-hexahydro-16-hydroxy-14-(β-L-lyxofuranosyloxy)-3-methyl-, (3S,5Z)- [ACD/Index Name]
β-L-Lyxofuranoside de (3S,5Z)-16-hydroxy-3-méthyl-1,11-dioxo-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotétradécin-14-yle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 765.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.9±3.0 kJ/mol
Flash Point: 263.6±26.4 °C
Index of Refraction: 1.566
Molar Refractivity: 112.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.64
ACD/KOC (pH 5.5): 236.04
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 5.14
ACD/KOC (pH 7.4): 82.90
Polar Surface Area: 143 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 346.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement