methyl (2E,4E)-6,9-bis(oxidanyl)-8-oxidanylidene-icosa-2,4-dienoate

Systemtic Name: methyl (2E,4E)-6,9-bis(oxidanyl)-8-oxidanylidene-icosa-2,4-dienoate Openeye Name: methyl (2E,4E)-6,9-dihydroxy-8-oxo-icosa-2,4-dienoate CAS Name: (2E,4E)-6,9-dihydroxy-8-oxoeicosa-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E,4E)-6,9-dihydroxy-8-oxoicosa-2,4-dienoate Traditional Name: (2E,4E)-6,9-dihydroxy-8-keto-eicosa-2,4-dienoic acid methyl ester Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(=O)CC(C=CC=CC(=O)OC)O)O

Isomeric SMILES

CCCCCCCCCCCC(C(=O)CC(/C=C/C=C/C(=O)OC)O)O

InChI

InChI=1S/C21H36O5/c1-3-4-5-6-7-8-9-10-11-15-19(23)20(24)17-18(22)14-12-13-16-21(25)26-2/h12-14,16,18-19,22-23H,3-11,15,17H2,1-2H3/b14-12+,16-13+