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

Systemtic Name: [2-ethyl-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] octadecanoate Openeye Name: [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] octadecanoate CAS Name: octadecanoic acid [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: [2-ethyl-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] octadecanoate Traditional Name: stearic acid (2-ethyl-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester Formula: C26H50O7 MolecularWeight: 474.671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1(C(C(C(C(O1)CO)O)O)O)CC

InChI

InChI=1S/C26H50O7/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(28)33-26(4-2)25(31)24(30)23(29)21(20-27)32-26/h21,23-25,27,29-31H,3-20H2,1-2H3