[(7E,10E,13E,16E)-2-hexadecanoyl-3-oxidanylidene-2-phosphonooxy-docosa-7,10,13,16-tetraenyl]-trimethyl-azanium

Systemtic Name: [(7E,10E,13E,16E)-2-hexadecanoyl-3-oxidanylidene-2-phosphonooxy-docosa-7,10,13,16-tetraenyl]-trimethyl-azanium Openeye Name: [(7E,10E,13E,16E)-2-hexadecanoyl-3-oxo-2-phosphonooxy-docosa-7,10,13,16-tetraenyl]-trimethyl-ammonium CAS Name: trimethyl-[(7E,10E,13E,16E)-3-oxo-2-(1-oxohexadecyl)-2-phosphonooxydocosa-7,10,13,16-tetraenyl]ammonium IUPAC Name: [(7E,10E,13E,16E)-2-hexadecanoyl-3-oxo-2-phosphonooxydocosa-7,10,13,16-tetraenyl]-trimethylazanium Traditional Name: [(7E,10E,13E,16E)-2-hexadecanoyl-3-keto-2-phosphonooxy-docosa-7,10,13,16-tetraenyl]-trimethyl-ammonium Formula: C41H75NO6P+ MolecularWeight: 709.011061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C[N+](C)(C)C)(C(=O)CCCC=CCC=CCC=CCC=CCCCCC)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C[N+](C)(C)C)(C(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)OP(=O)(O)O

InChI

InChI=1S/C41H74NO6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-40(44)41(38-42(3,4)5,48-49(45,46)47)39(43)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,29,31H,6-13,15,17-19,22,24,26-28,30,32-38H2,1-5H3,(H-,45,46,47)/p+1/b16-14+,21-20+,25-23+,31-29+