(9Z,11E,13S)-9,10,12,13-tetradeuterio-13-oxidanyl-octadeca-9,11-dienoic acid

Systemtic Name: (9Z,11E,13S)-9,10,12,13-tetradeuterio-13-oxidanyl-octadeca-9,11-dienoic acid Openeye Name: (9Z,11E,13S)-9,10,12,13-tetradeuterio-13-hydroxy-octadeca-9,11-dienoic acid CAS Name: (9Z,11E,13S)-9,10,12,13-tetradeuterio-13-hydroxyoctadeca-9,11-dienoic acid IUPAC Name: (9Z,11E,13S)-9,10,12,13-tetradeuterio-13-hydroxyoctadeca-9,11-dienoic acid Traditional Name: (9Z,11E,13S)-9,10,12,13-tetradeuterio-13-hydroxy-octadeca-9,11-dienoic acid Formula: C18H32O3 MolecularWeight: 300.469527

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC=CCCCCCCCC(=O)O)O

Isomeric SMILES

[2H]/C(=C(\[2H])/C=C(\[2H])/[C@]([2H])(CCCCC)O)/CCCCCCCC(=O)O

InChI

InChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+/t17-/m0/s1/i7D,9D,15D,17D