(E)-7-[(3E,5E)-7-oxidanyldodeca-3,5-dienyl]sulfanylhept-5-enoic acid

Systemtic Name: (E)-7-[(3E,5E)-7-oxidanyldodeca-3,5-dienyl]sulfanylhept-5-enoic acid Openeye Name: (E)-7-[(3E,5E)-7-hydroxydodeca-3,5-dienyl]sulfanylhept-5-enoic acid CAS Name: (E)-7-[[(3E,5E)-7-hydroxydodeca-3,5-dienyl]thio]-5-heptenoic acid IUPAC Name: (E)-7-[(3E,5E)-7-hydroxydodeca-3,5-dienyl]sulfanylhept-5-enoic acid Traditional Name: (E)-7-[[(3E,5E)-7-hydroxydodeca-3,5-dienyl]thio]hept-5-enoic acid Formula: C19H32O3S MolecularWeight: 340.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC=CCCSCC=CCCCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C=C/CCSC/C=C/CCCC(=O)O)O

InChI

InChI=1S/C19H32O3S/c1-2-3-8-13-18(20)14-9-4-6-11-16-23-17-12-7-5-10-15-19(21)22/h4,6-7,9,12,14,18,20H,2-3,5,8,10-11,13,15-17H2,1H3,(H,21,22)/b6-4+,12-7+,14-9+