2-[[(2R)-2,3-bis[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-2,3-bis[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-2,3-bis[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-2,3-bis[(9Z,12Z)-1-oxoheptadeca-9,12-dienoxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-2,3-bis[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-2,3-bis[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C42H77NO8P+ MolecularWeight: 755.036441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCC

Isomeric SMILES

CCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCC

InChI

InChI=1S/C42H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h12-15,18-21,40H,6-11,16-17,22-39H2,1-5H3/p+1/b14-12-,15-13-,20-18-,21-19-/t40-/m1/s1