[(2R,3S,4R,5R,6S)-2-[(2S,3R,4S,5S,6S)-5-[ethanoyl(phenylsulfonyl)amino]-6-methoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl] ethanoate

Systemtic Name: [(2R,3S,4R,5R,6S)-2-[(2S,3R,4S,5S,6S)-5-[ethanoyl(phenylsulfonyl)amino]-6-methoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl] ethanoate Openeye Name: [(2R,3S,4R,5R,6S)-2-[(2S,3R,4S,5S,6S)-5-[acetyl(benzenesulfonyl)amino]-4-benzyloxy-2-(benzyloxymethyl)-6-methoxy-tetrahydropyran-3-yl]oxy-4,5-dibenzyloxy-6-(benzyloxymethyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3S,4R,5R,6S)-2-[[(2S,3R,4S,5S,6S)-5-[acetyl(benzenesulfonyl)amino]-6-methoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-3-oxanyl] ester IUPAC Name: [(2R,3S,4R,5R,6S)-2-[(2S,3R,4S,5S,6S)-5-[acetyl(benzenesulfonyl)amino]-6-methoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6S)-2-[(2S,3R,4S,5S,6S)-5-[acetyl(besyl)amino]-4-benzoxy-2-(benzoxymethyl)-6-methoxy-tetrahydropyran-3-yl]oxy-4,5-dibenzoxy-6-(benzoxymethyl)tetrahydropyran-3-yl] ester Formula: C58H63NO14S MolecularWeight: 1030.18412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1C(C(C(OC1OC)COCC2=CC=CC=C2)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OC(=O)C)OCC7=CC=CC=C7)S(=O)(=O)C8=CC=CC=C8

Isomeric SMILES

CC(=O)N([C@H]1[C@@H]([C@H]([C@@H](O[C@@H]1OC)COCC2=CC=CC=C2)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H](O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OC(=O)C)OCC7=CC=CC=C7)S(=O)(=O)C8=CC=CC=C8

InChI

InChI=1S/C58H63NO14S/c1-41(60)59(74(62,63)48-32-20-9-21-33-48)51-54(68-37-46-28-16-7-17-29-46)53(50(71-57(51)64-3)40-66-35-44-24-12-5-13-25-44)73-58-56(70-42(2)61)55(69-38-47-30-18-8-19-31-47)52(67-36-45-26-14-6-15-27-45)49(72-58)39-65-34-43-22-10-4-11-23-43/h4-33,49-58H,34-40H2,1-3H3/t49-,50-,51-,52+,53-,54-,55+,56-,57-,58+/m0/s1