[5-(methylamino)-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] hexadecanoate

Systemtic Name: [5-(methylamino)-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] hexadecanoate Openeye Name: [2,3,4-trihydroxy-5-(methylamino)-6-oxo-hexyl] hexadecanoate CAS Name: hexadecanoic acid [2,3,4-trihydroxy-5-(methylamino)-6-oxohexyl] ester IUPAC Name: [2,3,4-trihydroxy-5-(methylamino)-6-oxohexyl] hexadecanoate Traditional Name: palmitic acid [2,3,4-trihydroxy-6-keto-5-(methylamino)hexyl] ester Formula: C23H45NO6 MolecularWeight: 431.6065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(C(C(C(C=O)NC)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(C(C(C(C=O)NC)O)O)O

InChI

InChI=1S/C23H45NO6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21(27)30-18-20(26)23(29)22(28)19(17-25)24-2/h17,19-20,22-24,26,28-29H,3-16,18H2,1-2H3