[1,3,4,6-tetrakis(oxidanyl)-5-sulfooxy-hexan-2-yl] hydrogen sulfate

Systemtic Name: [1,3,4,6-tetrakis(oxidanyl)-5-sulfooxy-hexan-2-yl] hydrogen sulfate Openeye Name: [2,3,5-trihydroxy-1-(hydroxymethyl)-4-sulfooxy-pentyl] hydrogen sulfate CAS Name: sulfuric acid (1,3,4,6-tetrahydroxy-5-sulfooxyhexan-2-yl) ester IUPAC Name: (1,3,4,6-tetrahydroxy-5-sulfooxyhexan-2-yl) hydrogen sulfate Traditional Name: sulfuric acid (2,3,5-trihydroxy-1-methylol-4-sulfoxy-pentyl) ester Formula: C6H14O12S2 MolecularWeight: 342.29816

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C(CO)OS(=O)(=O)O)O)O)OS(=O)(=O)O)O

Isomeric SMILES

C(C(C(C(C(CO)OS(=O)(=O)O)O)O)OS(=O)(=O)O)O

InChI

InChI=1S/C6H14O12S2/c7-1-3(17-19(11,12)13)5(9)6(10)4(2-8)18-20(14,15)16/h3-10H,1-2H2,(H,11,12,13)(H,14,15,16)