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

Systemtic Name: [(2S,3R,4R,5S,6S)-5-acetyloxy-2-ethylsulfanyl-6-methyl-3-(phenylcarbonyloxy)oxan-4-yl] benzoate Openeye Name: [(2S,3R,4R,5S,6S)-5-acetoxy-3-benzoyloxy-2-ethylsulfanyl-6-methyl-tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [(2S,3R,4R,5S,6S)-5-acetyloxy-3-benzoyloxy-2-(ethylthio)-6-methyl-4-oxanyl] ester IUPAC Name: [(2S,3R,4R,5S,6S)-5-acetyloxy-3-benzoyloxy-2-ethylsulfanyl-6-methyloxan-4-yl] benzoate Traditional Name: benzoic acid [(2S,3R,4R,5S,6S)-5-acetoxy-3-benzoyloxy-2-(ethylthio)-6-methyl-tetrahydropyran-4-yl] ester Formula: C24H26O7S MolecularWeight: 458.52404

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C(C(C(O1)C)OC(=O)C)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C24H26O7S/c1-4-32-24-21(31-23(27)18-13-9-6-10-14-18)20(19(15(2)28-24)29-16(3)25)30-22(26)17-11-7-5-8-12-17/h5-15,19-21,24H,4H2,1-3H3/t15-,19-,20+,21+,24-/m0/s1