(E)-13-(dioxidanyl)-9-oxidanyl-10-oxidanylidene-octadec-11-enoic acid

Systemtic Name: (E)-13-(dioxidanyl)-9-oxidanyl-10-oxidanylidene-octadec-11-enoic acid Openeye Name: (E)-13-hydroperoxy-9-hydroxy-10-oxo-octadec-11-enoic acid CAS Name: (E)-13-hydroperoxy-9-hydroxy-10-oxo-11-octadecenoic acid IUPAC Name: (E)-13-hydroperoxy-9-hydroxy-10-oxooctadec-11-enoic acid Traditional Name: (E)-13-hydroperoxy-9-hydroxy-10-keto-octadec-11-enoic acid Formula: C18H32O6 MolecularWeight: 344.44308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC(=O)C(CCCCCCCC(=O)O)O)OO

Isomeric SMILES

CCCCCC(/C=C/C(=O)C(CCCCCCCC(=O)O)O)OO

InChI

InChI=1S/C18H32O6/c1-2-3-7-10-15(24-23)13-14-17(20)16(19)11-8-5-4-6-9-12-18(21)22/h13-16,19,23H,2-12H2,1H3,(H,21,22)/b14-13+