ChemSpider 2D Image | Glucosylceramide (d18:1/9Z-18:1) | C42H79NO8

Glucosylceramide (d18:1/9Z-18:1)

  • Molecular FormulaC42H79NO8
  • Average mass726.079 Da
  • Monoisotopic mass725.580566 Da
  • ChemSpider ID16744955

  • 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 (d18:1/9Z-18:1)
(9Z)-N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]-9-octadecenamid [German] [ACD/IUPAC Name]
(9Z)-N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]-9-octadecenamide [ACD/IUPAC Name]
(9Z)-N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadécén-2-yl]-9-octadécénamide [French] [ACD/IUPAC Name]
(9z)-N-[(2s,3r,4e)-1-(β-D-Glucopyranosyloxy)-3-Hydroxyoctadec-4-En-2-Yl]octadec-9-Enamide
85305-87-9 [RN]
9-Octadecenamide, N-[(1S,2R,3E)-1-[(β-D-glucopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]-, (9Z)- [ACD/Index Name]
1-O-b-D-glucopyranosyl-Ceramide
1-O-β-δ-glucopyranosyl-Ceramide
Ganglioside GL1a
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: 858.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 141.7±6.0 kJ/mol
Flash Point: 472.7±34.3 °C
Index of Refraction: 1.521
Molar Refractivity: 209.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 3
ACD/LogP: 11.77
ACD/LogD (pH 5.5): 10.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 149 Å2
Polarizability: 82.9±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 686.3±5.0 cm3

Click to predict properties on the Chemicalize site


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