[(2S)-2,3-Bis[(3R,11R)-3,7,11,15-Tetramethylhexadecoxy]Propyl] 2-Trimethylazaniumylethyl Phosphate
[CAS# 103067-81-8]

Identification

• Name: [(2S)-2,3-Bis[(3R,11R)-3,7,11,15-Tetramethylhexadecoxy]Propyl] 2-Trimethylazaniumylethyl Phosphate
• Synonyms: [(2S)-2,3-Bis[(3R,11R)-3,7,11,15-Tetramethylhexadecoxy]Propyl] 2-Trimethylammonioethyl Phosphate; 2,3-Di-O-Phytanyl-Sn-Glycero-1-Phosphocholine; 2,3-Di-O-Phytanylphosphatidylcholine
• Molecular Formula: C₄₈H₁₀₀NO₆P
• Molecular Weight: 818.29
• CAS Registry Number: 103067-81-8
• SMILES: [C@@H](OCC[C@@H](CCCC(CCC[C@@H](CCCC(C)C)C)C)C)(CO[P](OCC[N+](C)(C)C)([O-])=O)COCC[C@@H](CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C
• InChI: 1S/C48H100NO6P/c1-40(2)20-14-22-42(5)24-16-26-44(7)28-18-30-46(9)32-35-52-38-48(39-55-56(50,51)54-37-34-49(11,12)13)53-36-33-47(10)31-19-29-45(8)27-17-25-43(6)23-15-21-41(3)4/h40-48H,14-39H2,1-13H3/t42-,43-,44-,45?,46-,47-,48+/m1/s1
• InChIKey: NMRGXROOSPKRTL-ZUIQINDNSA-N