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

Systemtic Name: [2-azanyl-4,5-bis(oxidanyl)-1-oxidanylidene-6-sulfooxy-hexan-3-yl] hydrogen sulfate Openeye Name: (5-amino-2,3-dihydroxy-6-oxo-4-sulfooxy-hexyl) hydrogen sulfate CAS Name: sulfuric acid (2-amino-4,5-dihydroxy-1-oxo-6-sulfooxyhexan-3-yl) ester IUPAC Name: (2-amino-4,5-dihydroxy-1-oxo-6-sulfooxyhexan-3-yl) hydrogen sulfate Traditional Name: sulfuric acid (5-amino-2,3-dihydroxy-6-keto-4-sulfoxy-hexyl) ester Formula: C6H13NO11S2 MolecularWeight: 339.29752

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C(C=O)N)OS(=O)(=O)O)O)O)OS(=O)(=O)O

Isomeric SMILES

C(C(C(C(C(C=O)N)OS(=O)(=O)O)O)O)OS(=O)(=O)O

InChI

InChI=1S/C6H13NO11S2/c7-3(1-8)6(18-20(14,15)16)5(10)4(9)2-17-19(11,12)13/h1,3-6,9-10H,2,7H2,(H,11,12,13)(H,14,15,16)