1,2-Di-(Heptacosadiynoyl)-Sn-Glycero-3-Phosphocholine
[CAS# 118024-74-1]

Identification

• Name: 1,2-Di-(Heptacosadiynoyl)-Sn-Glycero-3-Phosphocholine
• Synonyms: [(2R)-2,3-Di(Heptacosa-11,13-Diynoyloxy)Propyl] 2-Trimethylammonioethyl Phosphate; [(2R)-2,3-Bis(1-Oxoheptacosa-11,13-Diynoxy)Propyl] 2-Trimethylammonioethyl Phosphate; 3,5,9-Trioxa-4-Phosphahexatriaconta-20,22-Diyn-1-Aminium, 4-Hydroxy-N,N,N-Trimethyl-10-Oxo-7-((1-Oxo-11,13-Heptacosadiynyl)Oxy)-, Hydroxide, Inner Salt, 4-Oxide, (R)-
• Molecular Formula: C₆₂H₁₀₈NO₈P
• Molecular Weight: 1026.51
• CAS Registry Number: 118024-74-1
• SMILES: [C@H](CO[P](OCC[N+](C)(C)C)(=O)[O-])(COC(CCCCCCCCCC#CC#CCCCCCCCCCCCCC)=O)OC(CCCCCCCCCC#CC#CCCCCCCCCCCCCC)=O
• InChI: 1S/C62H108NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-50-52-54-61(64)68-58-60(59-70-72(66,67)69-57-56-63(3,4)5)71-62(65)55-53-51-49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h60H,6-29,38-59H2,1-5H3/t60-/m1/s1
• InChIKey: AFGIQTGBUXLTHP-AKAJXFOGSA-N