[5-acetamido-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] hydrogen sulfate; sodium

Systemtic Name: [5-acetamido-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] hydrogen sulfate; sodium Openeye Name: (5-acetamido-2,3,4-trihydroxy-6-oxo-hexyl) hydrogen sulfate; sodium CAS Name: sodium; sulfuric acid (5-acetamido-2,3,4-trihydroxy-6-oxohexyl) ester IUPAC Name: (5-acetamido-2,3,4-trihydroxy-6-oxohexyl) hydrogen sulfate; sodium Traditional Name: sodium; sulfuric acid (5-acetamido-2,3,4-trihydroxy-6-keto-hexyl) ester Formula: C8H15NNaO9S MolecularWeight: 324.26077

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C=O)C(C(C(COS(=O)(=O)O)O)O)O.[Na]

Isomeric SMILES

CC(=O)NC(C=O)C(C(C(COS(=O)(=O)O)O)O)O.[Na]

InChI

InChI=1S/C8H15NO9S.Na/c1-4(11)9-5(2-10)7(13)8(14)6(12)3-18-19(15,16)17;/h2,5-8,12-14H,3H2,1H3,(H,9,11)(H,15,16,17);