6,7-bis(oxidanyl)-7-(2-oxidanylidene-3-propyl-hexyl)-4-propyl-heptadecane-5,8-dione

Systemtic Name: 6,7-bis(oxidanyl)-7-(2-oxidanylidene-3-propyl-hexyl)-4-propyl-heptadecane-5,8-dione Openeye Name: 6,7-dihydroxy-7-(2-oxo-3-propyl-hexyl)-4-propyl-heptadecane-5,8-dione CAS Name: 6,7-dihydroxy-7-(2-oxo-3-propylhexyl)-4-propylheptadecane-5,8-dione IUPAC Name: 6,7-dihydroxy-7-(2-oxo-3-propylhexyl)-4-propylheptadecane-5,8-dione Traditional Name: 6,7-dihydroxy-7-(2-keto-3-propyl-hexyl)-4-propyl-heptadecane-5,8-dione Formula: C29H54O5 MolecularWeight: 482.73606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)C(CC(=O)C(CCC)CCC)(C(C(=O)C(CCC)CCC)O)O

Isomeric SMILES

CCCCCCCCCC(=O)C(CC(=O)C(CCC)CCC)(C(C(=O)C(CCC)CCC)O)O

InChI

InChI=1S/C29H54O5/c1-6-11-12-13-14-15-16-21-26(31)29(34,22-25(30)23(17-7-2)18-8-3)28(33)27(32)24(19-9-4)20-10-5/h23-24,28,33-34H,6-22H2,1-5H3