sodium [(2R,3R,4S,5R)-2-methoxy-4,5-bis(phenylcarbonyloxy)oxan-3-yl] sulfate

Systemtic Name: sodium [(2R,3R,4S,5R)-2-methoxy-4,5-bis(phenylcarbonyloxy)oxan-3-yl] sulfate Openeye Name: sodium [(2R,3R,4S,5R)-4,5-dibenzoyloxy-2-methoxy-tetrahydropyran-3-yl] sulfate CAS Name: sodium [(2R,3R,4S,5R)-4,5-dibenzoyloxy-2-methoxy-3-oxanyl] sulfate IUPAC Name: sodium [(2R,3R,4S,5R)-4,5-dibenzoyloxy-2-methoxyoxan-3-yl] sulfate Traditional Name: sodium [(2R,3R,4S,5R)-4,5-dibenzoyloxy-2-methoxy-tetrahydropyran-3-yl] sulfate Formula: C20H19NaO10S MolecularWeight: 474.41363

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(CO1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CO[C@H]1[C@@H]([C@H]([C@@H](CO1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H20O10S.Na/c1-26-20-17(30-31(23,24)25)16(29-19(22)14-10-6-3-7-11-14)15(12-27-20)28-18(21)13-8-4-2-5-9-13;/h2-11,15-17,20H,12H2,1H3,(H,23,24,25);/q;+1/p-1/t15-,16+,17-,20-;/m1./s1