(5E,8E,11E)-13-oxidanyl-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoic acid

Systemtic Name: (5E,8E,11E)-13-oxidanyl-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoic acid Openeye Name: (5E,8E,11E)-13-hydroxy-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoic acid CAS Name: (5E,8E,11E)-13-hydroxy-13-(3-pentyl-2-oxiranyl)trideca-5,8,11-trienoic acid IUPAC Name: (5E,8E,11E)-13-hydroxy-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienoic acid Traditional Name: (5E,8E,11E)-13-(3-amyloxiran-2-yl)-13-hydroxy-trideca-5,8,11-trienoic acid Formula: C20H32O4 MolecularWeight: 336.46568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32O4/c1-2-3-11-15-18-20(24-18)17(21)14-12-9-7-5-4-6-8-10-13-16-19(22)23/h5-8,12,14,17-18,20-21H,2-4,9-11,13,15-16H2,1H3,(H,22,23)/b7-5+,8-6+,14-12+