8-methylsulfonyl-12-oxidanyl-heptadec-16-enoic acid

Systemtic Name: 8-methylsulfonyl-12-oxidanyl-heptadec-16-enoic acid Openeye Name: 12-hydroxy-8-methylsulfonyl-heptadec-16-enoic acid CAS Name: 12-hydroxy-8-methylsulfonyl-16-heptadecenoic acid IUPAC Name: 12-hydroxy-8-methylsulfonylheptadec-16-enoic acid Traditional Name: 12-hydroxy-8-mesyl-heptadec-16-enoic acid Formula: C18H34O5S MolecularWeight: 362.52456

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(CCCCCCC(=O)O)CCCC(CCCC=C)O

Isomeric SMILES

CS(=O)(=O)C(CCCCCCC(=O)O)CCCC(CCCC=C)O

InChI

InChI=1S/C18H34O5S/c1-3-4-7-11-16(19)12-10-14-17(24(2,22)23)13-8-5-6-9-15-18(20)21/h3,16-17,19H,1,4-15H2,2H3,(H,20,21)