(2-oxidanyl-3-phosphonooxy-propyl) (8E,12Z)-10-(dioxidanyl)octadeca-8,12-dienoate

Systemtic Name: (2-oxidanyl-3-phosphonooxy-propyl) (8E,12Z)-10-(dioxidanyl)octadeca-8,12-dienoate Openeye Name: (2-hydroxy-3-phosphonooxy-propyl) (8E,12Z)-10-hydroperoxyoctadeca-8,12-dienoate CAS Name: (8E,12Z)-10-hydroperoxyoctadeca-8,12-dienoic acid (2-hydroxy-3-phosphonooxypropyl) ester IUPAC Name: (2-hydroxy-3-phosphonooxypropyl) (8E,12Z)-10-hydroperoxyoctadeca-8,12-dienoate Traditional Name: (8E,12Z)-10-hydroperoxyoctadeca-8,12-dienoic acid (2-hydroxy-3-phosphonooxy-propyl) ester Formula: C21H39O9P MolecularWeight: 466.502721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC(C=CCCCCCCC(=O)OCC(COP(=O)(O)O)O)OO

Isomeric SMILES

CCCCC/C=C\CC(/C=C/CCCCCCC(=O)OCC(COP(=O)(O)O)O)OO

InChI

InChI=1S/C21H39O9P/c1-2-3-4-5-8-11-14-20(30-24)15-12-9-6-7-10-13-16-21(23)28-17-19(22)18-29-31(25,26)27/h8,11-12,15,19-20,22,24H,2-7,9-10,13-14,16-18H2,1H3,(H2,25,26,27)/b11-8-,15-12+