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

Systemtic Name: [(2R,3R,4R,5R,6S)-5-acetyloxy-2-methoxy-6-methyl-4-oxidanyl-oxan-3-yl] benzoate Openeye Name: [(2R,3R,4R,5R,6S)-5-acetoxy-4-hydroxy-2-methoxy-6-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4R,5R,6S)-5-acetyloxy-4-hydroxy-2-methoxy-6-methyl-3-oxanyl] ester IUPAC Name: [(2R,3R,4R,5R,6S)-5-acetyloxy-4-hydroxy-2-methoxy-6-methyloxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4R,5R,6S)-5-acetoxy-4-hydroxy-2-methoxy-6-methyl-tetrahydropyran-3-yl] ester Formula: C16H20O7 MolecularWeight: 324.3258

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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)C

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)C

InChI

InChI=1S/C16H20O7/c1-9-13(22-10(2)17)12(18)14(16(20-3)21-9)23-15(19)11-7-5-4-6-8-11/h4-9,12-14,16,18H,1-3H3/t9-,12+,13-,14+,16+/m0/s1