2-(12,12-dimethyl-13-oxidanyl-tridecyl)-3-oxidanyl-pentanedioic acid

Systemtic Name: 2-(12,12-dimethyl-13-oxidanyl-tridecyl)-3-oxidanyl-pentanedioic acid Openeye Name: 3-hydroxy-2-(13-hydroxy-12,12-dimethyl-tridecyl)pentanedioic acid CAS Name: 3-hydroxy-2-(13-hydroxy-12,12-dimethyltridecyl)pentanedioic acid IUPAC Name: 3-hydroxy-2-(13-hydroxy-12,12-dimethyltridecyl)pentanedioic acid Traditional Name: 3-hydroxy-2-(13-hydroxy-12,12-dimethyl-tridecyl)glutaric acid Formula: C20H38O6 MolecularWeight: 374.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCCCCCCCC(C(CC(=O)O)O)C(=O)O)CO

Isomeric SMILES

CC(C)(CCCCCCCCCCCC(C(CC(=O)O)O)C(=O)O)CO

InChI

InChI=1S/C20H38O6/c1-20(2,15-21)13-11-9-7-5-3-4-6-8-10-12-16(19(25)26)17(22)14-18(23)24/h16-17,21-22H,3-15H2,1-2H3,(H,23,24)(H,25,26)