[6-(hydroxymethyl)-2,4-bis(oxidanyl)-5-sulfooxy-oxan-3-yl] tetradecanoate

Systemtic Name: [6-(hydroxymethyl)-2,4-bis(oxidanyl)-5-sulfooxy-oxan-3-yl] tetradecanoate Openeye Name: [2,4-dihydroxy-6-(hydroxymethyl)-5-sulfooxy-tetrahydropyran-3-yl] tetradecanoate CAS Name: tetradecanoic acid [2,4-dihydroxy-6-(hydroxymethyl)-5-sulfooxy-3-oxanyl] ester IUPAC Name: [2,4-dihydroxy-6-(hydroxymethyl)-5-sulfooxyoxan-3-yl] tetradecanoate Traditional Name: myristic acid (2,4-dihydroxy-6-methylol-5-sulfoxy-tetrahydropyran-3-yl) ester Formula: C20H38O10S MolecularWeight: 470.57472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC1C(C(C(OC1O)CO)OS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC1C(C(C(OC1O)CO)OS(=O)(=O)O)O

InChI

InChI=1S/C20H38O10S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(22)29-19-17(23)18(30-31(25,26)27)15(14-21)28-20(19)24/h15,17-21,23-24H,2-14H2,1H3,(H,25,26,27)