ChemSpider 2D Image | Glucosylceramide (d18:1/18:0) | C42H81NO8

Glucosylceramide (d18:1/18:0)

  • Molecular FormulaC42H81NO8
  • Average mass728.094 Da
  • Monoisotopic mass727.596191 Da
  • ChemSpider ID10132611
  • 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 (d18:1/18:0)
85305-87-9 [RN]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]octadecanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]octadecanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-4-octadécén-2-yl]octadécanamide [French] [ACD/IUPAC Name]
Octadecanamide, N-[(1S,2R,3E)-1-[(β-D-glucopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]- [ACD/Index Name]
β-D-glucosyl-N-octadecanoylsphingosine
1-O-b-D-glucopyranosyl-Ceramide
1-O-β-δ-glucopyranosyl-Ceramide
Ganglioside GL1a
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

nchembio850-comp2 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 857.7±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: 472.5±34.3 °C
Index of Refraction: 1.516
Molar Refractivity: 209.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 3
ACD/LogP: 12.29
ACD/LogD (pH 5.5): 11.49
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.49
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: 47.2±5.0 dyne/cm
Molar Volume: 693.0±5.0 cm3

Click to predict properties on the Chemicalize site






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