(2E,4E,6E)-11-oxidanyl-13-(3-pentyloxiran-2-yl)trideca-2,4,6-trienoic acid

Systemtic Name: (2E,4E,6E)-11-oxidanyl-13-(3-pentyloxiran-2-yl)trideca-2,4,6-trienoic acid Openeye Name: (2E,4E,6E)-11-hydroxy-13-(3-pentyloxiran-2-yl)trideca-2,4,6-trienoic acid CAS Name: (2E,4E,6E)-11-hydroxy-13-(3-pentyl-2-oxiranyl)trideca-2,4,6-trienoic acid IUPAC Name: (2E,4E,6E)-11-hydroxy-13-(3-pentyloxiran-2-yl)trideca-2,4,6-trienoic acid Traditional Name: (2E,4E,6E)-13-(3-amyloxiran-2-yl)-11-hydroxy-trideca-2,4,6-trienoic acid Formula: C20H32O4 MolecularWeight: 336.46568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(O1)CCC(CCCC=CC=CC=CC(=O)O)O

Isomeric SMILES

CCCCCC1C(O1)CCC(CCC/C=C/C=C/C=C/C(=O)O)O

InChI

InChI=1S/C20H32O4/c1-2-3-9-13-18-19(24-18)16-15-17(21)12-10-7-5-4-6-8-11-14-20(22)23/h4-6,8,11,14,17-19,21H,2-3,7,9-10,12-13,15-16H2,1H3,(H,22,23)/b5-4+,8-6+,14-11+