[(3R)-1-[(2R,3R,4R,5S,6R)-2-Fluoro-6-(Hydroxymethyl)-3-(3-Hydroxytetradecanoylamino)-5-Phosphonooxyoxan-4-Yl]Oxy-1-Oxotetradecan-3-Yl] Tetradecanoate
[CAS# 138527-40-9]

Identification

• Name: [(3R)-1-[(2R,3R,4R,5S,6R)-2-Fluoro-6-(Hydroxymethyl)-3-(3-Hydroxytetradecanoylamino)-5-Phosphonooxyoxan-4-Yl]Oxy-1-Oxotetradecan-3-Yl] Tetradecanoate
• Synonyms: [(1R)-1-[2-[(2R,3R,4R,5S,6R)-2-Fluoro-6-(Hydroxymethyl)-3-(3-Hydroxytetradecanoylamino)-5-Phosphonooxy-Tetrahydropyran-4-Yl]Oxy-2-Oxo-Ethyl]Dodecyl] Tetradecanoate; Tetradecanoic Acid [(1R)-1-[2-[[(2R,3R,4R,5S,6R)-2-Fluoro-6-(Hydroxymethyl)-3-[(3-Hydroxy-1-Oxotetradecyl)Amino]-5-Phosphonooxy-4-Tetrahydropyranyl]Oxy]-2-Oxoethyl]Dodecyl] Ester; Myristic Acid [(1R)-1-[2-[(2R,3R,4R,5S,6R)-2-Fluoro-3-(3-Hydroxytetradecanoylamino)-6-Methylol-5-Phosphonooxy-Tetrahydropyran-4-Yl]Oxy-2-Keto-Ethyl]Dodecyl] Ester
• Molecular Formula: C₄₈H₉₁FNO₁₂P
• Molecular Weight: 924.22
• CAS Registry Number: 138527-40-9
• SMILES: [C@H]1(CO)O[C@@H]([C@H](NC(=O)CC(O)CCCCCCCCCCC)[C@H]([C@@H]1O[P](O)(=O)O)OC(=O)C[C@H](OC(=O)CCCCCCCCCCCCC)CCCCCCCCCCC)F
• InChI: 1S/C48H91FNO12P/c1-4-7-10-13-16-19-20-23-26-29-32-35-43(54)59-40(34-31-28-25-22-18-15-12-9-6-3)37-44(55)61-47-45(48(49)60-41(38-51)46(47)62-63(56,57)58)50-42(53)36-39(52)33-30-27-24-21-17-14-11-8-5-2/h39-41,45-48,51-52H,4-38H2,1-3H3,(H,50,53)(H2,56,57,58)/t39?,40-,41-,45-,46-,47-,48+/m1/s1
• InChIKey: DMSHXHBPCDSLRB-BCMHDZJLSA-N

Properties

• Density: 1.109g/cm³ (Cal.)