[2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-octadec-9-enoate

Systemtic Name: [2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-octadec-9-enoate Openeye Name: [2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [2-[(E)-1-oxohexadec-9-enoxy]-3-phosphonooxypropyl] ester IUPAC Name: [2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxypropyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] ester Formula: C37H69O8P MolecularWeight: 672.912721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCC=CCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCC/C=C/CCCCCC

InChI

InChI=1S/C37H69O8P/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/h14,16-18,35H,3-13,15,19-34H2,1-2H3,(H2,40,41,42)/b16-14+,18-17+