1-Oleoyl-2-(7-(4-Nitrobenzo-2-Oxa-1,3-Diazole))-6-Aminocaproylphosphatidylcholine
[CAS# 99566-32-2]

Identification

• Name: 1-Oleoyl-2-(7-(4-Nitrobenzo-2-Oxa-1,3-Diazole))-6-Aminocaproylphosphatidylcholine
• Synonyms: [2-[6-[(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]Hexanoyloxy]-3-[(Z)-Octadec-9-Enoyl]Oxy-Propyl] 2-Trimethylammonioethyl Phosphate; [2-[6-[(4-Nitro-2,1,3-Benzoxadiazol-7-Yl)Amino]-1-Oxohexoxy]-3-[(Z)-1-Oxooctadec-9-Enoxy]Propyl] 2-Trimethylammonioethyl Phosp
• Molecular Formula: C₃₈H₆₄N₅O₁₁P
• Molecular Weight: 797.92
• CAS Registry Number: 99566-32-2
• SMILES: C2=C([N+]([O-])=O)C1=NON=C1C(=C2)NCCCCCC(OC(CO[P](OCC[N+](C)(C)C)([O-])=O)COC(=O)CCCCCCC\C=C/CCCCCCCC)=O
• InChI: 1S/C38H64N5O11P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23-35(44)50-30-32(31-52-55(48,49)51-29-28-43(2,3)4)53-36(45)24-21-19-22-27-39-33-25-26-34(42(46)47)38-37(33)40-54-41-38/h12-13,25-26,32H,5-11,14-24,27-31H2,1-4H3,(H-,39,41,48,49)/b13-12-
• InChIKey: OEOBAFBXLIMNCV-SEYXRHQNSA-N