[2-[3,4-bis(oxidanyl)oxolan-2-yl]-1,4,5-tris(oxidanyl)pentan-2-yl] octadecanoate

Systemtic Name: [2-[3,4-bis(oxidanyl)oxolan-2-yl]-1,4,5-tris(oxidanyl)pentan-2-yl] octadecanoate Openeye Name: [1-(3,4-dihydroxytetrahydrofuran-2-yl)-3,4-dihydroxy-1-(hydroxymethyl)butyl] octadecanoate CAS Name: octadecanoic acid [2-(3,4-dihydroxy-2-oxolanyl)-1,4,5-trihydroxypentan-2-yl] ester IUPAC Name: [2-(3,4-dihydroxyoxolan-2-yl)-1,4,5-trihydroxypentan-2-yl] octadecanoate Traditional Name: stearic acid [1-(3,4-dihydroxytetrahydrofuran-2-yl)-3,4-dihydroxy-1-methylol-butyl] ester Formula: C27H52O8 MolecularWeight: 504.69698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CC(CO)O)(CO)C1C(C(CO1)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CC(CO)O)(CO)C1C(C(CO1)O)O

InChI

InChI=1S/C27H52O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(32)35-27(21-29,18-22(30)19-28)26-25(33)23(31)20-34-26/h22-23,25-26,28-31,33H,2-21H2,1H3