ChemSpider 2D Image | Mucocin | C37H66O8

Mucocin

  • Molecular FormulaC37H66O8
  • Average mass638.915 Da
  • Monoisotopic mass638.475769 Da
  • ChemSpider ID8184882

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(5S)-3-[(2R)-9-[(2R,5S)-5-[(1S,4S)-4-[(2S,5R,6S)-6-Decyltetrahydro-5-hydroxy-2H-pyran-2-yl]-1,4-dihydroxybutyl]tetrahydro-2-furanyl]-2-hydroxynonyl]-5-methyl-2(5H)-furanone
(5S)-3-{(2R)-9-[(2R,5S)-5-{(1S,4S)-4-[(2S,5R,6S)-6-Decyl-5-hydroxytetrahydro-2H-pyran-2-yl]-1,4-dihydroxybutyl}tetrahydro-2-furanyl]-2-hydroxynonyl}-5-methyl-2(5H)-furanon [German] [ACD/IUPAC Name]
(5S)-3-{(2R)-9-[(2R,5S)-5-{(1S,4S)-4-[(2S,5R,6S)-6-Decyl-5-hydroxytetrahydro-2H-pyran-2-yl]-1,4-dihydroxybutyl}tetrahydro-2-furanyl]-2-hydroxynonyl}-5-methyl-2(5H)-furanone [ACD/IUPAC Name]
(5S)-3-{(2R)-9-[(2R,5S)-5-{(1S,4S)-4-[(2S,5R,6S)-6-Décyl-5-hydroxytétrahydro-2H-pyran-2-yl]-1,4-dihydroxybutyl}tétrahydro-2-furanyl]-2-hydroxynonyl}-5-méthyl-2(5H)-furanone [French] [ACD/IUPAC Name]
170591-47-6 [RN]
2(5H)-Furanone, 3-[(2R)-9-[(2R,5S)-5-[(1S,4S)-4-[(2S,5R,6S)-6-decyltetrahydro-5-hydroxy-2H-pyran-2-yl]-1,4-dihydroxybutyl]tetrahydro-2-furanyl]-2-hydroxynonyl]-5-methyl-, (5S)- [ACD/Index Name]
Mucocin

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

Density: 1.1±0.1 g/cm3
Boiling Point: 780.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.1 mmHg at 25°C
Enthalpy of Vaporization: 129.5±6.0 kJ/mol
Flash Point: 232.1±25.0 °C
Index of Refraction: 1.509
Molar Refractivity: 177.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 6.95
ACD/BCF (pH 5.5): 113230.31
ACD/KOC (pH 5.5): 144279.61
ACD/LogD (pH 7.4): 6.95
ACD/BCF (pH 7.4): 113230.31
ACD/KOC (pH 7.4): 144279.61
Polar Surface Area: 126 Å2
Polarizability: 70.5±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 596.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement