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

Systemtic Name: [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-ethylsulfanyl-5-phenylmethoxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4-diacetoxy-5-benzyloxy-6-ethylsulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-(ethylthio)-5-phenylmethoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-ethylsulfanyl-5-phenylmethoxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-3,4-diacetoxy-5-benzoxy-6-(ethylthio)tetrahydropyran-2-yl]methyl ester Formula: C21H28O8S MolecularWeight: 440.50722

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

CCS[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28O8S/c1-5-30-21-20(26-11-16-9-7-6-8-10-16)19(28-15(4)24)18(27-14(3)23)17(29-21)12-25-13(2)22/h6-10,17-21H,5,11-12H2,1-4H3/t17-,18-,19+,20-,21-/m1/s1