N-[(2S,3S,4S,5R,6R)-3-iodanyl-4-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-(phenylmethoxymethyl)oxan-2-yl]benzenesulfonamide

Systemtic Name: N-[(2S,3S,4S,5R,6R)-3-iodanyl-4-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-(phenylmethoxymethyl)oxan-2-yl]benzenesulfonamide Openeye Name: N-[(2S,3S,4S,5R,6R)-6-(benzyloxymethyl)-5-[(2S,3R,4S,5S,6R)-4,5-dibenzyloxy-6-(benzyloxymethyl)-3-[(2S,3S,4R,5R,6S)-3,4,5-tribenzyloxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3-iodo-4-[(2S,3S,4R,5R,6S)-3,4,5-tribenzyloxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]benzenesulfonamide CAS Name: N-[(2S,3S,4S,5R,6R)-3-iodo-4-[[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)-2-oxanyl]oxy]-5-[[(2S,3R,4S,5S,6R)-3-[[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)-2-oxanyl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]oxy]-6-(phenylmethoxymethyl)-2-oxanyl]benzenesulfonamide IUPAC Name: N-[(2S,3S,4S,5R,6R)-3-iodo-4-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-5-[(2S,3R,4S,5S,6R)-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-6-(phenylmethoxymethyl)oxan-2-yl]benzenesulfonamide Traditional Name: N-[(2S,3S,4S,5R,6R)-6-(benzoxymethyl)-5-[(2S,3R,4S,5S,6R)-4,5-dibenzoxy-6-(benzoxymethyl)-3-[(2S,3S,4R,5R,6S)-3,4,5-tribenzoxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3-iodo-4-[(2S,3S,4R,5R,6S)-3,4,5-tribenzoxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]benzenesulfonamide Formula: C100H106INO19S MolecularWeight: 1784.87641

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(OC(C2I)NS(=O)(=O)C3=CC=CC=C3)COCC4=CC=CC=C4)OC5C(C(C(C(O5)COCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)OC9C(C(C(C(O9)C)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@@H]([C@H]2I)NS(=O)(=O)C3=CC=CC=C3)COCC4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)COCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)O[C@H]9[C@H]([C@@H]([C@@H]([C@@H](O9)C)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1

InChI

InChI=1S/C100H106INO19S/c1-70-86(107-60-74-40-18-5-19-41-74)91(110-63-77-46-24-8-25-47-77)94(113-66-80-52-30-11-31-53-80)98(115-70)120-90-85(101)97(102-122(103,104)82-56-34-13-35-57-82)117-84(69-106-59-73-38-16-4-17-39-73)89(90)119-100-96(93(112-65-79-50-28-10-29-51-79)88(109-62-76-44-22-7-23-45-76)83(118-100)68-105-58-72-36-14-3-15-37-72)121-99-95(114-67-81-54-32-12-33-55-81)92(111-64-78-48-26-9-27-49-78)87(71(2)116-99)108-61-75-42-20-6-21-43-75/h3-57,70-71,83-100,102H,58-69H2,1-2H3/t70-,71-,83+,84+,85-,86+,87+,88-,89+,90+,91+,92+,93-,94-,95-,96+,97-,98-,99-,100-/m0/s1