[(2R,4R)-4-phenylmethoxy-2-(sulfonatooxymethyl)oxan-3-yl] sulfate

Systemtic Name: [(2R,4R)-4-phenylmethoxy-2-(sulfonatooxymethyl)oxan-3-yl] sulfate Openeye Name: [(2R,4R)-4-benzyloxy-2-(sulfonatooxymethyl)tetrahydropyran-3-yl] sulfate CAS Name: [(2R,4R)-4-phenylmethoxy-2-(sulfonatooxymethyl)-3-oxanyl] sulfate IUPAC Name: [(2R,4R)-4-phenylmethoxy-2-(sulfonatooxymethyl)oxan-3-yl] sulfate Traditional Name: [(2R,4R)-4-benzoxy-2-(sulfatomethyl)tetrahydropyran-3-yl] sulfate Formula: C13H16O10S2-2 MolecularWeight: 396.39014

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C(C1OCC2=CC=CC=C2)OS(=O)(=O)[O-])COS(=O)(=O)[O-]

Isomeric SMILES

C1CO[C@@H](C([C@@H]1OCC2=CC=CC=C2)OS(=O)(=O)[O-])COS(=O)(=O)[O-]

InChI

InChI=1S/C13H18O10S2/c14-24(15,16)22-9-12-13(23-25(17,18)19)11(6-7-20-12)21-8-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2,(H,14,15,16)(H,17,18,19)/p-2/t11-,12-,13?/m1/s1