[3-[Hydroxy-[Hydroxy-[[5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]Phosphoryl]Oxyphosphoryl]Oxy-2-(10-Pyren-1-Yldecanoyloxy)Propyl] Tetradecanoate
[CAS# 141848-06-8]

Identification

• Name: [3-[Hydroxy-[Hydroxy-[[5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]Phosphoryl]Oxyphosphoryl]Oxy-2-(10-Pyren-1-Yldecanoyloxy)Propyl] Tetradecanoate
• Synonyms: [3-[Hydroxy-[Hydroxy-[[5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy]Phosphoryl]Oxy-Phosphoryl]Oxy-2-(10-Pyren-1-Yldecanoyloxy)Propyl] Tetradecanoate; Tetradecanoic Acid [3-[Hydroxy-[Hydroxy-[[5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methoxy]Phosphoryl]Oxyphosphoryl]Oxy-2-[1-Oxo-10-(1-Pyrenyl)Decoxy]Propyl] Ester; Myristic Acid [3-[[[5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxy-2-(10-Pyren-1-Yldecanoyloxy)Propyl] Ester
• Molecular Formula: C₅₃H₇₄N₂O₁₄P₂
• Molecular Weight: 1025.12
• CAS Registry Number: 141848-06-8
• SMILES: C3=CC1=CC=CC2=CC=C4C(=C12)C3=C(C=C4)CCCCCCCCCC(OC(CO[P](O[P](OCC6OC(N5C(=O)NC(=O)C(=C5)C)CC6)(=O)O)(=O)O)COC(=O)CCCCCCCCCCCCC)=O
• InChI: 1S/C53H74N2O14P2/c1-3-4-5-6-7-8-9-10-13-16-19-25-48(56)64-36-45(38-66-71(62,63)69-70(60,61)65-37-44-32-34-47(67-44)55-35-39(2)52(58)54-53(55)59)68-49(57)26-20-17-14-11-12-15-18-22-40-27-28-43-30-29-41-23-21-24-42-31-33-46(40)51(43)50(41)42/h21,23-24,27-31,33,35,44-45,47H,3-20,22,25-26,32,34,36-38H2,1-2H3,(H,60,61)(H,62,63)(H,54,58,59)
• InChIKey: MQGGXSSNCXZTHC-UHFFFAOYSA-N

Properties

• Density: 1.249g/cm³ (Cal.)