[(2R)-3-Hexadecanoyloxy-2-[11-[Methyl-(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]Undecanoyloxy]Propyl] 2-Trimethylazaniumylethyl Phosphate
[CAS# 108535-67-7]

Identification

• Name: [(2R)-3-Hexadecanoyloxy-2-[11-[Methyl-(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]Undecanoyloxy]Propyl] 2-Trimethylazaniumylethyl Phosphate
• Synonyms: [(2R)-3-Hexadecanoyloxy-2-[11-[Methyl-(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]Undecanoyloxy]Propyl] 2-Trimethylammonioethyl Phosphate; [(2R)-2-[11-[Methyl-(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]-1-Oxoundecoxy]-3-(1-Oxohexadecoxy)Propyl] 2-Trimethylammonioethyl Phosphate; [(2R)-3-Hexadecanoyloxy-2-[11-[Methyl-(7-Nitrobenzofurazan-4-Yl)Amino]Undecanoyloxy]Propyl] 2-Trimethylammonioethyl Phosphate
• Molecular Formula: C₄₂H₇₄N₅O₁₁P
• Molecular Weight: 856.05
• CAS Registry Number: 108535-67-7
• SMILES: [C@H](OC(=O)CCCCCCCCCCN(C1=CC=C([N+]([O-])=O)C2=NON=C12)C)(CO[P](OCC[N+](C)(C)C)([O-])=O)COC(=O)CCCCCCCCCCCCCCC
• InChI: 1S/C42H74N5O11P/c1-6-7-8-9-10-11-12-13-14-15-18-21-24-27-39(48)54-34-36(35-56-59(52,53)55-33-32-47(3,4)5)57-40(49)28-25-22-19-16-17-20-23-26-31-45(2)37-29-30-38(46(50)51)42-41(37)43-58-44-42/h29-30,36H,6-28,31-35H2,1-5H3/t36-/m1/s1
• InChIKey: ORIATWTXJGGODP-PSXMRANNSA-N