[(2R,3R,4R)-4-methoxy-2-oxidanyl-5-oxidanylidene-3-(phenylcarbonyloxy)-5-phosphonooxy-pentyl] benzoate

Systemtic Name: [(2R,3R,4R)-4-methoxy-2-oxidanyl-5-oxidanylidene-3-(phenylcarbonyloxy)-5-phosphonooxy-pentyl] benzoate Openeye Name: [(2R,3R,4R)-3-benzoyloxy-2-hydroxy-4-methoxy-5-oxo-5-phosphonooxy-pentyl] benzoate CAS Name: benzoic acid [(2R,3R,4R)-3-benzoyloxy-2-hydroxy-4-methoxy-5-oxo-5-phosphonooxypentyl] ester IUPAC Name: [(2R,3R,4R)-3-benzoyloxy-2-hydroxy-4-methoxy-5-oxo-5-phosphonooxypentyl] benzoate Traditional Name: benzoic acid [(2R,3R,4R)-3-benzoyloxy-2-hydroxy-5-keto-4-methoxy-5-phosphonooxy-pentyl] ester Formula: C20H21O11P MolecularWeight: 468.347901

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(C(COC(=O)C1=CC=CC=C1)O)OC(=O)C2=CC=CC=C2)C(=O)OP(=O)(O)O

Isomeric SMILES

CO[C@H]([C@@H]([C@@H](COC(=O)C1=CC=CC=C1)O)OC(=O)C2=CC=CC=C2)C(=O)OP(=O)(O)O

InChI

InChI=1S/C20H21O11P/c1-28-17(20(24)31-32(25,26)27)16(30-19(23)14-10-6-3-7-11-14)15(21)12-29-18(22)13-8-4-2-5-9-13/h2-11,15-17,21H,12H2,1H3,(H2,25,26,27)/t15-,16-,17-/m1/s1