ChemSpider 2D Image | Ganglioside GA2 (d18:1/20:0) | C58H108N2O18

Ganglioside GA2 (d18:1/20:0)

  • Molecular FormulaC58H108N2O18
  • Average mass1121.481 Da
  • Monoisotopic mass1120.759766 Da
  • ChemSpider ID17216284
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 16 of 17 defined stereocentres


More details:






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

Ganglioside GA2 (d18:1/20:0)
88506-68-7 [RN]
Eicosanamide, N-[(1S,2R,3E)-1-[[[O-2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1->4)-O-β-D-galactopyranosyl-(1->4)-β-D-mannopyranosyl]oxy]methyl]-2-hydroxy-3-heptadecen-1-yl]- [ACD/Index Name]
N-[(2S,3R,4E)-1-{[2-Acetamido-2-deoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-mannopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]icosanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-{[2-Acetamido-2-desoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-mannopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]icosanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-{[2-Acétamido-2-désoxy-β-D-galactopyranosyl-(1->4)-β-D-galactopyranosyl-(1->4)-β-D-mannopyranosyl]oxy}-3-hydroxy-4-octadécén-2-yl]icosanamide [French] [ACD/IUPAC Name]
Asialo GM2
Bissulfogangliotetraosylceramide
G(A2) Ganglioside
GA2
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 1190.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 199.1±6.0 kJ/mol
Flash Point: 673.8±34.3 °C
Index of Refraction: 1.553
Molar Refractivity: 297.4±0.4 cm3
#H bond acceptors: 20
#H bond donors: 12
#Freely Rotating Bonds: 44
#Rule of 5 Violations: 4
ACD/LogP: 12.82
ACD/LogD (pH 5.5): 9.76
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4827195.00
ACD/LogD (pH 7.4): 9.76
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4827174.00
Polar Surface Area: 316 Å2
Polarizability: 117.9±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 929.5±5.0 cm3

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