[(2S,3R,4R,5R,6S)-6-methyl-4-oxidanyl-5-phenylmethoxy-2-phenylsulfanyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4R,5R,6S)-6-methyl-4-oxidanyl-5-phenylmethoxy-2-phenylsulfanyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3R,4R,5R,6S)-5-benzyloxy-4-hydroxy-6-methyl-2-phenylsulfanyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4R,5R,6S)-4-hydroxy-6-methyl-5-phenylmethoxy-2-(phenylthio)-3-oxanyl] ester IUPAC Name: [(2S,3R,4R,5R,6S)-4-hydroxy-6-methyl-5-phenylmethoxy-2-phenylsulfanyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4R,5R,6S)-5-benzoxy-4-hydroxy-6-methyl-2-(phenylthio)tetrahydropyran-3-yl] ester Formula: C21H24O5S MolecularWeight: 388.47726

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)SC2=CC=CC=C2)OC(=O)C)O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)SC2=CC=CC=C2)OC(=O)C)O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24O5S/c1-14-19(24-13-16-9-5-3-6-10-16)18(23)20(26-15(2)22)21(25-14)27-17-11-7-4-8-12-17/h3-12,14,18-21,23H,13H2,1-2H3/t14-,18+,19-,20+,21-/m0/s1