1-O-(α-D-Galactopyranuronosyl)-N-Tetradecanoyldihydrosphingosine

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Properties Simple | Detailed

Formula C38H73NO9
IUPAC Name (2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-[(2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadecoxy]tetrahydropyran-2-carboxylic acid
Molecular Mass 687.988 g·mol−1
Heat of Formation -2304.0 ± 16.7 kJ·mol−1
Dipole Moment 2.99 ± 1.08 D
Volume 943.91 Å 3
Surface Area 816.79 Å 2
HOMO Energy -9.95 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadecyl alpha-d-galactopyranosiduronic acid
  • (2s,3r)-n-myristoyl-1-o-(alpha-d-galacturonosyl)-2-n-octadecane-3-ol
  • (2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-[(2s,3r)-3-hydroxy-2-(1-oxotetradecylamino)octadecoxy]-2-tetrahydropyrancarboxylic acid
  • (2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-[(2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadecoxy]oxane-2-carboxylic acid
  • (2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-[(2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadecoxy]tetrahydropyran-2-carboxylic acid
  • gsl
InChIKey IRPOZWRRAFKYMQ-LMIAXWKISA-N
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