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

Systemtic Name: magnesium [6-(hydroxymethyl)-2-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl] octadecanoate Openeye Name: magnesium [4,5-dihydroxy-6-(hydroxymethyl)-2-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl] octadecanoate CAS Name: magnesium octadecanoic acid [4,5-dihydroxy-6-(hydroxymethyl)-2-[[4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-3-oxanyl] ester IUPAC Name: magnesium [4,5-dihydroxy-6-(hydroxymethyl)-2-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl] octadecanoate Traditional Name: magnesium stearic acid [4,5-dihydroxy-6-methylol-2-(4,5,6-trihydroxy-2-methylol-tetrahydropyran-3-yl)oxy-tetrahydropyran-3-yl] ester Formula: C30H56MgO12+2 MolecularWeight: 633.06344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2C(OC(C(C2O)O)O)CO)CO)O)O.[Mg+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2C(OC(C(C2O)O)O)CO)CO)O)O.[Mg+2]

InChI

InChI=1S/C30H56O12.Mg/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)41-28-24(35)23(34)20(18-31)40-30(28)42-27-21(19-32)39-29(38)26(37)25(27)36;/h20-21,23-32,34-38H,2-19H2,1H3;/q;+2