[(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(Hydroxymethyl)-6-[(E,2S,3R)-3-Hydroxy-2-(Tetracosanoylamino)Octadec-4-Enoxy]Oxan-4-Yl] Hydrogen Sulfate
[CAS# 151122-71-3]

Identification

• Name: [(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(Hydroxymethyl)-6-[(E,2S,3R)-3-Hydroxy-2-(Tetracosanoylamino)Octadec-4-Enoxy]Oxan-4-Yl] Hydrogen Sulfate
• Synonyms: [(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(Hydroxymethyl)-6-[(E,2S,3R)-3-Hydroxy-2-(Tetracosanoylamino)Octadec-4-Enoxy]Tetrahydropyran-4-Yl] Hydrogen Sulfate; [(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(Hydroxymethyl)-6-[(E,2S,3R)-3-Hydroxy-2-(1-Oxotetracosylamino)Octadec-4-Enoxy]-4-Tetrahydropyranyl] Hydrogen Sulfate; [(2R,3R,4S,5S,6R)-3,5-Dihydroxy-2-[(E,2S,3R)-3-Hydroxy-2-(Tetracosanoylamino)Octadec-4-Enoxy]-6-Methylol-Tetrahydropyran-4-Yl] Hydrogen Sulfate
• Molecular Formula: C₄₈H₉₃NO₁₁S
• Molecular Weight: 892.32
• CAS Registry Number: 151122-71-3
• SMILES: [C@@H]1(O[S](=O)(=O)O)[C@@H](O)[C@@H](O[C@@H]([C@@H]1O)CO)OC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[C@H](O)\C=C\CCCCCCCCCCCCC
• InChI: 1S/C48H93NO11S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(52)49-41(42(51)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)40-58-48-46(54)47(60-61(55,56)57)45(53)43(39-50)59-48/h35,37,41-43,45-48,50-51,53-54H,3-34,36,38-40H2,1-2H3,(H,49,52)(H,55,56,57)/b37-35+/t41-,42+,43+,45-,46+,47-,48+/m0/s1
• InChIKey: MEAZTWJVOWHKJM-CIAPRIGGSA-N

Properties

• Density: 1.097g/cm³ (Cal.)