hexadecanoic acid; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one

Systemtic Name: hexadecanoic acid; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one Openeye Name: palmitic acid; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: hexadecanoic acid; 1,3,4,5,6-pentahydroxy-2-hexanone IUPAC Name: hexadecanoic acid; 1,3,4,5,6-pentahydroxyhexan-2-one Traditional Name: palmitic acid; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C22H44O8 MolecularWeight: 436.57996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)O.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C16H32O2.C6H12O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;7-1-3(9)5(11)6(12)4(10)2-8/h2-15H2,1H3,(H,17,18);3,5-9,11-12H,1-2H2