9-oxidanyl-10-sulfooxy-octadecanoic acid

Systemtic Name: 9-oxidanyl-10-sulfooxy-octadecanoic acid Openeye Name: 9-hydroxy-10-sulfooxy-octadecanoic acid CAS Name: 9-hydroxy-10-sulfooxyoctadecanoic acid IUPAC Name: 9-hydroxy-10-sulfooxyoctadecanoic acid Traditional Name: 9-hydroxy-10-sulfoxy-stearic acid Formula: C18H36O7S MolecularWeight: 396.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCC(=O)O)O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCC(=O)O)O)OS(=O)(=O)O

InChI

InChI=1S/C18H36O7S/c1-2-3-4-5-8-11-14-17(25-26(22,23)24)16(19)13-10-7-6-9-12-15-18(20)21/h16-17,19H,2-15H2,1H3,(H,20,21)(H,22,23,24)