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

Systemtic Name: [6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] octadecan-2-yl sulfate Openeye Name: 1-methylheptadecyl [3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] sulfate CAS Name: sulfuric acid octadecan-2-yl [3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: octadecan-2-yl [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] sulfate Traditional Name: sulfuric acid 1-methylheptadecyl (3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester Formula: C24H48O9S MolecularWeight: 512.69752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)OS(=O)(=O)OC1C(C(C(C(O1)CO)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)OS(=O)(=O)OC1C(C(C(C(O1)CO)O)O)O

InChI

InChI=1S/C24H48O9S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(2)32-34(29,30)33-24-23(28)22(27)21(26)20(18-25)31-24/h19-28H,3-18H2,1-2H3