[3-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-2-yl] (1E)-4-oxidanyl-N-sulfooxy-butanimidothioate

Systemtic Name: [3-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-2-yl] (1E)-4-oxidanyl-N-sulfooxy-butanimidothioate Openeye Name: [4,5,6-trihydroxy-3-(hydroxymethyl)tetrahydropyran-2-yl] (1E)-4-hydroxy-N-sulfooxy-butanimidothioate CAS Name: (1E)-4-hydroxy-N-sulfooxybutanimidothioic acid [4,5,6-trihydroxy-3-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: [4,5,6-trihydroxy-3-(hydroxymethyl)oxan-2-yl] (1E)-4-hydroxy-N-sulfooxybutanimidothioate Traditional Name: (1E)-4-hydroxy-N-sulfoxy-thiobutyrimidic acid (4,5,6-trihydroxy-3-methylol-tetrahydropyran-2-yl) ester Formula: C10H19NO10S2 MolecularWeight: 377.38856

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)O)O)O)CO)CO

Isomeric SMILES

C(C/C(=N\OS(=O)(=O)O)/SC1C(C(C(C(O1)O)O)O)CO)CO

InChI

InChI=1S/C10H19NO10S2/c12-3-1-2-6(11-21-23(17,18)19)22-10-5(4-13)7(14)8(15)9(16)20-10/h5,7-10,12-16H,1-4H2,(H,17,18,19)/b11-6+