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

Systemtic Name: [(2R,3R,4R,5S,6S)-4-acetyloxy-5,6-dimethoxy-3-oxidanyl-oxan-2-yl]methyl benzoate Openeye Name: [(2R,3R,4R,5S,6S)-4-acetoxy-3-hydroxy-5,6-dimethoxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R,4R,5S,6S)-4-acetyloxy-3-hydroxy-5,6-dimethoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4R,5S,6S)-4-acetyloxy-3-hydroxy-5,6-dimethoxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R,4R,5S,6S)-4-acetoxy-3-hydroxy-5,6-dimethoxy-tetrahydropyran-2-yl]methyl ester Formula: C17H22O8 MolecularWeight: 354.35178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC(C1OC)OC)COC(=O)C2=CC=CC=C2)O

Isomeric SMILES

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

InChI

InChI=1S/C17H22O8/c1-10(18)24-14-13(19)12(25-17(22-3)15(14)21-2)9-23-16(20)11-7-5-4-6-8-11/h4-8,12-15,17,19H,9H2,1-3H3/t12-,13-,14-,15+,17+/m1/s1