[1,2-bis(oxidanyl)-6-oxidanylidene-4,5-disulfonatooxy-hexan-3-yl] sulfate

Systemtic Name: [1,2-bis(oxidanyl)-6-oxidanylidene-4,5-disulfonatooxy-hexan-3-yl] sulfate Openeye Name: [1-(1,2-dihydroxyethyl)-4-oxo-2,3-disulfonatooxy-butyl] sulfate CAS Name: (1,2-dihydroxy-6-oxo-4,5-disulfonatooxyhexan-3-yl) sulfate IUPAC Name: (1,2-dihydroxy-6-oxo-4,5-disulfonatooxyhexan-3-yl) sulfate Traditional Name: [1-(1,2-dihydroxyethyl)-4-keto-2,3-disulfato-butyl] sulfate Formula: C6H9O15S3-3 MolecularWeight: 417.32166

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C(C=O)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])O)O

Isomeric SMILES

C(C(C(C(C(C=O)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])O)O

InChI

InChI=1S/C6H12O15S3/c7-1-3(9)5(20-23(13,14)15)6(21-24(16,17)18)4(2-8)19-22(10,11)12/h2-7,9H,1H2,(H,10,11,12)(H,13,14,15)(H,16,17,18)/p-3