3-hexyl-4,5-bis(oxidanyl)-6-(8-oxidanyl-8-oxidanylidene-octyl)cyclohexane-1,2-dicarboxylic acid

Systemtic Name: 3-hexyl-4,5-bis(oxidanyl)-6-(8-oxidanyl-8-oxidanylidene-octyl)cyclohexane-1,2-dicarboxylic acid Openeye Name: 3-hexyl-4,5-dihydroxy-6-(8-hydroxy-8-oxo-octyl)cyclohexane-1,2-dicarboxylic acid CAS Name: 3-hexyl-4,5-dihydroxy-6-(8-hydroxy-8-oxooctyl)cyclohexane-1,2-dicarboxylic acid IUPAC Name: 3-hexyl-4,5-dihydroxy-6-(8-hydroxy-8-oxooctyl)cyclohexane-1,2-dicarboxylic acid Traditional Name: 3-hexyl-4,5-dihydroxy-6-(8-hydroxy-8-keto-octyl)cyclohexane-1,2-dicarboxylic acid Formula: C22H38O8 MolecularWeight: 430.53232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(C(C(C(C1O)O)CCCCCCCC(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCC1C(C(C(C(C1O)O)CCCCCCCC(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C22H38O8/c1-2-3-4-8-11-14-17(21(27)28)18(22(29)30)15(20(26)19(14)25)12-9-6-5-7-10-13-16(23)24/h14-15,17-20,25-26H,2-13H2,1H3,(H,23,24)(H,27,28)(H,29,30)