ChemSpider 2D Image | Glucosylceramide (d18:1/12:0) | C36H69NO8

Glucosylceramide (d18:1/12:0)

  • Molecular FormulaC36H69NO8
  • Average mass643.935 Da
  • Monoisotopic mass643.502319 Da
  • ChemSpider ID16744954

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

Glucosylceramide (d18:1/12:0)
111956-48-0 [RN]
85305-87-9 [RN]
Dodecanamide, N-[(1S,2R,3E)-1-[(β-D-glucopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]- [ACD/Index Name]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]dodecanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]dodecanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadécén-2-yl]dodécanamide [French] [ACD/IUPAC Name]
N-[1-[(β-D-Glucopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]dodecanamide
β-D-glucosyl-N-(dodecanoyl)sphingosine
1-O-b-D-glucopyranosyl-Ceramide
More...

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 813.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 134.5±6.0 kJ/mol
Flash Point: 445.5±34.3 °C
Index of Refraction: 1.520
Molar Refractivity: 181.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 3
ACD/LogP: 9.10
ACD/LogD (pH 5.5): 8.97
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1797797.25
ACD/LogD (pH 7.4): 8.97
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1797783.50
Polar Surface Area: 149 Å2
Polarizability: 71.9±0.5 10-24cm3
Surface Tension: 48.5±5.0 dyne/cm
Molar Volume: 596.9±5.0 cm3

Click to predict properties on the Chemicalize site


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