(Z,11R)-11-[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxyoctadec-9-enoic acid

Systemtic Name: (Z,11R)-11-[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxyoctadec-9-enoic acid Openeye Name: (Z,11R)-11-[(Z)-4-hydroxy-4-oxo-but-2-enoyl]oxyoctadec-9-enoic acid CAS Name: (Z,11R)-11-[(Z)-4-hydroxy-1,4-dioxobut-2-enoxy]-9-octadecenoic acid IUPAC Name: (Z,11R)-11-[(Z)-4-hydroxy-4-oxobut-2-enoyl]oxyoctadec-9-enoic acid Traditional Name: (Z,11R)-11-[(Z)-4-hydroxy-4-keto-but-2-enoyl]oxyoctadec-9-enoic acid Formula: C22H36O6 MolecularWeight: 396.51764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C=CCCCCCCCC(=O)O)OC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCC[C@H](/C=C\CCCCCCCC(=O)O)OC(=O)/C=C\C(=O)O

InChI

InChI=1S/C22H36O6/c1-2-3-4-8-11-14-19(28-22(27)18-17-21(25)26)15-12-9-6-5-7-10-13-16-20(23)24/h12,15,17-19H,2-11,13-14,16H2,1H3,(H,23,24)(H,25,26)/b15-12-,18-17-/t19-/m1/s1