disodium (2S,3R,4S,5R,6S)-6-oxidanidyl-3,4-bis(oxidanyl)-5-sulfooxy-oxane-2-carboxylate

Systemtic Name: disodium (2S,3R,4S,5R,6S)-6-oxidanidyl-3,4-bis(oxidanyl)-5-sulfooxy-oxane-2-carboxylate Openeye Name: disodium (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-oxido-5-sulfooxy-tetrahydropyran-2-carboxylate CAS Name: disodium (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-oxido-5-sulfooxy-2-oxanecarboxylate IUPAC Name: disodium (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-oxido-5-sulfooxyoxane-2-carboxylate Traditional Name: disodium (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-oxido-5-sulfoxy-tetrahydropyran-2-carboxylate Formula: C6H8Na2O10S MolecularWeight: 318.16626

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(C(OC(C1OS(=O)(=O)O)[O-])C(=O)[O-])O)O.[Na+].[Na+]

Isomeric SMILES

[C@@H]1([C@H]([C@H](O[C@@H]([C@@H]1OS(=O)(=O)O)[O-])C(=O)[O-])O)O.[Na+].[Na+]

InChI

InChI=1S/C6H9O10S.2Na/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10;;/h1-4,6-8H,(H,9,10)(H,12,13,14);;/q-1;2*+1/p-1/t1-,2+,3+,4-,6+;;/m1../s1