[1-[4,5-bis(oxidanyl)-3-sulfooxy-oxolan-2-yl]-2-sulfooxy-ethyl] hydrogen sulfate

Systemtic Name: [1-[4,5-bis(oxidanyl)-3-sulfooxy-oxolan-2-yl]-2-sulfooxy-ethyl] hydrogen sulfate Openeye Name: [1-(4,5-dihydroxy-3-sulfooxy-tetrahydrofuran-2-yl)-2-sulfooxy-ethyl] hydrogen sulfate CAS Name: sulfuric acid [1-(4,5-dihydroxy-3-sulfooxy-2-oxolanyl)-2-sulfooxyethyl] ester IUPAC Name: [1-(4,5-dihydroxy-3-sulfooxyoxolan-2-yl)-2-sulfooxyethyl] hydrogen sulfate Traditional Name: sulfuric acid [1-(4,5-dihydroxy-3-sulfoxy-tetrahydrofuran-2-yl)-2-sulfoxy-ethyl] ester Formula: C6H12O15S3 MolecularWeight: 420.34548

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C1C(C(C(O1)O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

C(C(C1C(C(C(O1)O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C6H12O15S3/c7-3-5(21-24(15,16)17)4(19-6(3)8)2(20-23(12,13)14)1-18-22(9,10)11/h2-8H,1H2,(H,9,10,11)(H,12,13,14)(H,15,16,17)