5,5-dihexyl-2-oxidanyl-4-oxidanylidene-undecane-1,2,3-tricarboxylic acid

Systemtic Name: 5,5-dihexyl-2-oxidanyl-4-oxidanylidene-undecane-1,2,3-tricarboxylic acid Openeye Name: 5,5-dihexyl-2-hydroxy-4-oxo-undecane-1,2,3-tricarboxylic acid CAS Name: 5,5-dihexyl-2-hydroxy-4-oxoundecane-1,2,3-tricarboxylic acid IUPAC Name: 5,5-dihexyl-2-hydroxy-4-oxoundecane-1,2,3-tricarboxylic acid Traditional Name: 5,5-dihexyl-2-hydroxy-4-keto-undecane-1,2,3-tricarboxylic acid Formula: C26H46O8 MolecularWeight: 486.63864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCC)(CCCCCC)C(=O)C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCCCCC(CCCCCC)(CCCCCC)C(=O)C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C26H46O8/c1-4-7-10-13-16-25(17-14-11-8-5-2,18-15-12-9-6-3)22(29)21(23(30)31)26(34,24(32)33)19-20(27)28/h21,34H,4-19H2,1-3H3,(H,27,28)(H,30,31)(H,32,33)