[(2R)-3-[[(2R,3S,4R,5R)-5-(4-Amino-2-Oxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl]Oxy-2-Hexadecanoyloxypropyl] Hexadecanoate
[CAS# 109430-98-0]

Identification

• Name: [(2R)-3-[[(2R,3S,4R,5R)-5-(4-Amino-2-Oxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl]Oxy-2-Hexadecanoyloxypropyl] Hexadecanoate
• Synonyms: [(2R)-3-[[(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-2-Hexadecanoyloxy-Propyl] Hexadecanoate; Hexadecanoic Acid [(2R)-3-[[(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-1-Pyrimidinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methoxy-Hydroxyphosphoryl]Oxy-2-(1-Oxohexadecoxy)Propyl] Ester; Palmitic Acid [(2R)-3-[[(2R,3S,4R,5R)-5-(4-Amino-2-Keto-Pyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-2-Hexadecanoyloxy-Propyl] Ester
• Molecular Formula: C₄₄H₈₀N₃O₁₂P
• Molecular Weight: 874.10
• CAS Registry Number: 109430-98-0
• SMILES: [C@@H]1(CO[P](=O)(OC[C@@H](COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCC)=O)O)[C@@H](O)[C@@H](O)[C@@H](O1)N2C(=O)N=C(N)C=C2
• InChI: 1S/C44H80N3O12P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-39(48)55-33-36(58-40(49)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)34-56-60(53,54)57-35-37-41(50)42(51)43(59-37)47-32-31-38(45)46-44(47)52/h31-32,36-37,41-43,50-51H,3-30,33-35H2,1-2H3,(H,53,54)(H2,45,46,52)/t36-,37-,41-,42-,43-/m1/s1
• InChIKey: FSGOTRMUMPHHJV-BQUKFSKHSA-N

Properties

• Density: 1.204g/cm³ (Cal.)
• Boiling point: 896.08°C at 760 mmHg (Cal.)
• Flash point: 495.732°C (Cal.)