[(3R)-1-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(Hydroxymethyl)-3-[[(3R)-3-Hydroxytetradecanoyl]Amino]-5-Phosphonooxyoxan-4-Yl]Oxy-1-Oxotetradecan-3-Yl] Tetradecanoate
[CAS# 111247-04-2]

Identification

• Name: [(3R)-1-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(Hydroxymethyl)-3-[[(3R)-3-Hydroxytetradecanoyl]Amino]-5-Phosphonooxyoxan-4-Yl]Oxy-1-Oxotetradecan-3-Yl] Tetradecanoate
• Synonyms: [(1R)-1-[2-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(Hydroxymethyl)-3-[[(3R)-3-Hydroxytetradecanoyl]Amino]-5-Phosphonooxy-Tetrahydropyran-4-Yl]Oxy-2-Oxo-Ethyl]Dodecyl] Tetradecanoate; Tetradecanoic Acid [(1R)-1-[2-[[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(Hydroxymethyl)-3-[[(3R)-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-Hydroxy-3-[[(3R)-3-Hydroxytetradecanoyl]Amino]-6-Methylol-5-Phosphonooxy-Tetrahydropyran-4-Yl]Oxy-2-Keto-Ethyl]Dodecyl] Ester
• Molecular Formula: C₄₈H₉₂NO₁₃P
• Molecular Weight: 922.23
• CAS Registry Number: 111247-04-2
• SMILES: [C@H]1([C@H]([C@@H](O[C@@H]([C@H]1O[P](=O)(O)O)CO)O)NC(C[C@H](O)CCCCCCCCCCC)=O)OC(C[C@H](OC(=O)CCCCCCCCCCCCC)CCCCCCCCCCC)=O
• InChI: 1S/C48H92NO13P/c1-4-7-10-13-16-19-20-23-26-29-32-35-43(53)59-40(34-31-28-25-22-18-15-12-9-6-3)37-44(54)61-47-45(48(55)60-41(38-50)46(47)62-63(56,57)58)49-42(52)36-39(51)33-30-27-24-21-17-14-11-8-5-2/h39-41,45-48,50-51,55H,4-38H2,1-3H3,(H,49,52)(H2,56,57,58)/t39-,40-,41-,45-,46-,47-,48-/m1/s1
• InChIKey: FZNYMGXKUGWDCL-MYRKYNHRSA-N

Properties

• Density: 1.117g/cm³ (Cal.)