[6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hexadecanoate

Systemtic Name: [6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hexadecanoate Openeye Name: [2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] hexadecanoate CAS Name: hexadecanoic acid [2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl] ester IUPAC Name: [2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl] hexadecanoate Traditional Name: palmitic acid (2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl) ester Formula: C22H42O7 MolecularWeight: 418.56468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1O)CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1O)CO)O)O

InChI

InChI=1S/C22H42O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)29-21-20(26)19(25)17(16-23)28-22(21)27/h17,19-23,25-27H,2-16H2,1H3