[(2R,3S,4S,5R,6S)-6-methoxy-2-methyl-4-oxidanyl-5-(phenylcarbonyloxy)oxan-3-yl] benzoate

Systemtic Name: [(2R,3S,4S,5R,6S)-6-methoxy-2-methyl-4-oxidanyl-5-(phenylcarbonyloxy)oxan-3-yl] benzoate Openeye Name: [(2R,3S,4S,5R,6S)-5-benzoyloxy-4-hydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3S,4S,5R,6S)-5-benzoyloxy-4-hydroxy-6-methoxy-2-methyl-3-oxanyl] ester IUPAC Name: [(2R,3S,4S,5R,6S)-5-benzoyloxy-4-hydroxy-6-methoxy-2-methyloxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3S,4S,5R,6S)-5-benzoyloxy-4-hydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC)OC(=O)C2=CC=CC=C2)O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)OC(=O)C2=CC=CC=C2)O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O7/c1-13-17(27-19(23)14-9-5-3-6-10-14)16(22)18(21(25-2)26-13)28-20(24)15-11-7-4-8-12-15/h3-13,16-18,21-22H,1-2H3/t13-,16+,17-,18-,21+/m1/s1