(3R,4R,5R)-oxane-2,3,4,5-tetrol; pyridine-3-carboxylate

Systemtic Name: (3R,4R,5R)-oxane-2,3,4,5-tetrol; pyridine-3-carboxylate Openeye Name: pyridine-3-carboxylate; (3R,4R,5R)-tetrahydropyran-2,3,4,5-tetrol CAS Name: (3R,4R,5R)-oxane-2,3,4,5-tetrol; 3-pyridinecarboxylate IUPAC Name: (3R,4R,5R)-oxane-2,3,4,5-tetrol; pyridine-3-carboxylate Traditional Name: nicotinate; (3R,4R,5R)-tetrahydropyran-2,3,4,5-tetrol Formula: C11H14NO7- MolecularWeight: 272.23136

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)O)O)O)O.C1=CC(=CN=C1)C(=O)[O-]

Isomeric SMILES

C1[C@H]([C@H]([C@H](C(O1)O)O)O)O.C1=CC(=CN=C1)C(=O)[O-]

InChI

InChI=1S/C6H5NO2.C5H10O5/c8-6(9)5-2-1-3-7-4-5;6-2-1-10-5(9)4(8)3(2)7/h1-4H,(H,8,9);2-9H,1H2/p-1/t;2-,3-,4-,5?/m.1/s1