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

Systemtic Name: [(2S,3S,4R,5R,6R)-5-acetyloxy-2-methyl-6-oxidanyl-4-(phenylcarbonyloxy)oxan-3-yl] benzoate Openeye Name: [(2S,3S,4R,5R,6R)-5-acetoxy-4-benzoyloxy-6-hydroxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3S,4R,5R,6R)-5-acetyloxy-4-benzoyloxy-6-hydroxy-2-methyl-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,5R,6R)-5-acetyloxy-4-benzoyloxy-6-hydroxy-2-methyloxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4R,5R,6R)-5-acetoxy-4-benzoyloxy-6-hydroxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C22H22O8 MolecularWeight: 414.40528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O8/c1-13-17(29-20(24)15-9-5-3-6-10-15)18(19(22(26)27-13)28-14(2)23)30-21(25)16-11-7-4-8-12-16/h3-13,17-19,22,26H,1-2H3/t13-,17-,18+,19+,22+/m0/s1