N-Glycoloylganglioside Gm2

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Properties Simple | Detailed

Formula C43H85NO8
IUPAC Name n-[(1s,2s)-2-hydroxy-1-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]octadecyl]octadecanamide
Molecular Mass 744.137 g·mol−1
Heat of Formation -2223.4 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 1043.76 Å 3
Surface Area 937.65 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy 1.19 ± eV
Point Group Symmetry C1
Synonyms
  • gm2
  • n-[(1s,2s)-2-hydroxy-1-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl]oxy}methyl)octadecyl]octadecanamide
  • n-[(1s,2s)-2-hydroxy-1-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]octadecyl]octadecanamide
  • n-[(1s,2s)-2-hydroxy-1-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]octadecyl]octadecanamide
  • n-[(1s,2s)-2-hydroxy-1-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]octadecyl]stearamide
  • n-[(2s,3s)-3-hydroxy-1-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-nonadecan-2-yl]octadecanamide
  • n-[(2s,3s)-3-hydroxy-1-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonadecan-2-yl]octadecanamide
InChIKey SYMIJCRAJBNLEL-YPQBUIQASA-N
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