[(2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-methoxy-3-(4-methylphenyl)sulfonyloxy-5-(phenylcarbonyloxy)oxan-4-yl] benzoate

Systemtic Name: [(2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-methoxy-3-(4-methylphenyl)sulfonyloxy-5-(phenylcarbonyloxy)oxan-4-yl] benzoate Openeye Name: [(2R,3R,4R,5R,6S)-5-benzoyloxy-2-(hydroxymethyl)-6-methoxy-3-(p-tolylsulfonyloxy)tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [(2R,3R,4R,5R,6S)-5-benzoyloxy-2-(hydroxymethyl)-6-methoxy-3-(4-methylphenyl)sulfonyloxy-4-oxanyl] ester IUPAC Name: [(2R,3R,4R,5R,6S)-5-benzoyloxy-2-(hydroxymethyl)-6-methoxy-3-(4-methylphenyl)sulfonyloxyoxan-4-yl] benzoate Traditional Name: benzoic acid [(2S,3R,4R,5R,6R)-3-benzoyloxy-2-methoxy-6-methylol-5-tosyloxy-tetrahydropyran-4-yl] ester Formula: C28H28O10S MolecularWeight: 556.58092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(OC(C(C2OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC)CO

InChI

InChI=1S/C28H28O10S/c1-18-13-15-21(16-14-18)39(32,33)38-23-22(17-29)35-28(34-2)25(37-27(31)20-11-7-4-8-12-20)24(23)36-26(30)19-9-5-3-6-10-19/h3-16,22-25,28-29H,17H2,1-2H3/t22-,23-,24+,25-,28+/m1/s1