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

Systemtic Name: [(2S,3S,4R,5R,6R)-4-acetyloxy-2-methyl-5-(phenylcarbonyloxy)-6-prop-2-enoxy-oxan-3-yl] benzoate Openeye Name: [(2S,3S,4R,5R,6R)-4-acetoxy-6-allyloxy-5-benzoyloxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3S,4R,5R,6R)-4-acetyloxy-5-benzoyloxy-2-methyl-6-prop-2-enoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,5R,6R)-4-acetyloxy-5-benzoyloxy-2-methyl-6-prop-2-enoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4R,5R,6R)-4-acetoxy-6-allyloxy-5-benzoyloxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C25H26O8 MolecularWeight: 454.46914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26O8/c1-4-15-29-25-22(33-24(28)19-13-9-6-10-14-19)21(31-17(3)26)20(16(2)30-25)32-23(27)18-11-7-5-8-12-18/h4-14,16,20-22,25H,1,15H2,2-3H3/t16-,20-,21+,22+,25+/m0/s1