[2-[(E)-hexadec-4-enoyl]oxy-3-phosphonooxy-propyl] (9Z,12Z)-octadeca-9,12-dienoate

Systemtic Name: [2-[(E)-hexadec-4-enoyl]oxy-3-phosphonooxy-propyl] (9Z,12Z)-octadeca-9,12-dienoate Openeye Name: [2-[(E)-hexadec-4-enoyl]oxy-3-phosphonooxy-propyl] (9Z,12Z)-octadeca-9,12-dienoate CAS Name: (9Z,12Z)-octadeca-9,12-dienoic acid [2-[(E)-1-oxohexadec-4-enoxy]-3-phosphonooxypropyl] ester IUPAC Name: [2-[(E)-hexadec-4-enoyl]oxy-3-phosphonooxypropyl] (9Z,12Z)-octadeca-9,12-dienoate Traditional Name: (9Z,12Z)-octadeca-9,12-dienoic acid [2-[(E)-hexadec-4-enoyl]oxy-3-phosphonooxy-propyl] ester Formula: C37H67O8P MolecularWeight: 670.896841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC=CCCC(=O)OC(COC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCC/C=C/CCC(=O)OC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COP(=O)(O)O

InChI

InChI=1S/C37H67O8P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,26,28,35H,3-10,12,14-16,19-25,27,29-34H2,1-2H3,(H2,40,41,42)/b13-11-,18-17-,28-26+