N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-8-[(4-methoxyphenyl)methoxy]-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[(2R,3S,4R,5R,6R)-6-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)-5-(phenylsulfonylamino)oxan-3-yl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]benzenesulfonamide

Systemtic Name: N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-8-[(4-methoxyphenyl)methoxy]-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[(2R,3S,4R,5R,6R)-6-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)-5-(phenylsulfonylamino)oxan-3-yl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]benzenesulfonamide Openeye Name: N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-7-benzyloxy-8-[(4-methoxyphenyl)methoxy]-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[(2R,3S,4R,5R,6R)-5-(benzenesulfonamido)-4-benzyloxy-2-(benzyloxymethyl)-6-[tert-butyl(dimethyl)silyl]oxy-tetrahydropyran-3-yl]oxy-4-benzyloxy-6-(benzyloxymethyl)tetrahydropyran-3-yl]benzenesulfonamide CAS Name: N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-8-[(4-methoxyphenyl)methoxy]-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[[(2R,3S,4R,5R,6R)-5-(benzenesulfonamido)-6-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl]oxy]-4-phenylmethoxy-6-(phenylmethoxymethyl)-3-oxanyl]benzenesulfonamide IUPAC Name: N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-8-[(4-methoxyphenyl)methoxy]-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[(2R,3S,4R,5R,6R)-5-(benzenesulfonamido)-6-[tert-butyl(dimethyl)silyl]oxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl]oxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]benzenesulfonamide Traditional Name: N-[(2S,3R,4R,5S,6R)-5-[[(2R,4aR,6S,7S,8S,8aR)-7-benzoxy-8-p-anisyloxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-[(2R,3S,4R,5R,6R)-5-(benzenesulfonamido)-4-benzoxy-2-(benzoxymethyl)-6-[tert-butyl(dimethyl)silyl]oxy-tetrahydropyran-3-yl]oxy-4-benzoxy-6-(benzoxymethyl)tetrahydropyran-3-yl]benzenesulfonamide Formula: C86H98N2O19S2Si MolecularWeight: 1555.91582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Si](C)(C)OC1C(C(C(C(O1)COCC2=CC=CC=C2)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OC5C(C(C6C(O5)COC(O6)C7=CC=CC=C7)OCC8=CC=C(C=C8)OC)OCC9=CC=CC=C9)OCC1=CC=CC=C1)NS(=O)(=O)C1=CC=CC=C1)OCC1=CC=CC=C1)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COCC4=CC=CC=C4)O[C@H]5[C@H]([C@H]([C@H]6[C@H](O5)CO[C@H](O6)C7=CC=CC=C7)OCC8=CC=C(C=C8)OC)OCC9=CC=CC=C9)OCC1=CC=CC=C1)NS(=O)(=O)C1=CC=CC=C1)OCC1=CC=CC=C1)NS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C86H98N2O19S2Si/c1-86(2,3)110(5,6)107-84-74(88-109(91,92)69-45-29-14-30-46-69)79(97-54-63-37-21-10-22-38-63)75(71(102-84)58-95-52-61-33-17-8-18-34-61)105-83-73(87-108(89,90)68-43-27-13-28-44-68)78(96-53-62-35-19-9-20-36-62)76(70(101-83)57-94-51-60-31-15-7-16-32-60)106-85-81(99-55-64-39-23-11-24-40-64)80(98-56-65-47-49-67(93-4)50-48-65)77-72(103-85)59-100-82(104-77)66-41-25-12-26-42-66/h7-50,70-85,87-88H,51-59H2,1-6H3/t70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80+,81+,82-,83+,84-,85+/m1/s1