ChemSpider 2D Image | (3R)-6-Hydroxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-1-oxo-3,4-dihydro-1H-isochromen-8-yl alpha-D-ribofuranoside | C21H28O9

(3R)-6-Hydroxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-1-oxo-3,4-dihydro-1H-isochromen-8-yl α-D-ribofuranoside

  • Molecular FormulaC21H28O9
  • Average mass424.442 Da
  • Monoisotopic mass424.173340 Da
  • ChemSpider ID44210816

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3R)-6-Hydroxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-1-oxo-3,4-dihydro-1H-isochromen-8-yl α-D-ribofuranoside [ACD/IUPAC Name]
(3R)-6-Hydroxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-1-oxo-3,4-dihydro-1H-isochromen-8-yl-α-D-ribofuranosid [German] [ACD/IUPAC Name]
1H-2-Benzopyran-1-one, 3,4-dihydro-6-hydroxy-8-(α-D-ribofuranosyloxy)-3-[[(2R,6S)-tetrahydro-6-methyl-2H-pyran-2-yl]methyl]-, (3R)- [ACD/Index Name]
α-D-Ribofuranoside de (3R)-6-hydroxy-3-{[(2R,6S)-6-méthyltétrahydro-2H-pyran-2-yl]méthyl}-1-oxo-3,4-dihydro-1H-isochromén-8-yle [French] [ACD/IUPAC Name]
Cladosporin 8-O-α-ribofuransoide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 738.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.1±3.0 kJ/mol
Flash Point: 260.2±26.4 °C
Index of Refraction: 1.593
Molar Refractivity: 103.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 7.12
ACD/KOC (pH 5.5): 141.65
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 4.75
ACD/KOC (pH 7.4): 94.53
Polar Surface Area: 135 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 305.7±3.0 cm3

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