[(2R,3S,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-[3-[bis[3-[(2S,3R,4R,5S,6R)-3-acetamido-4-acetyloxy-6-(acetyloxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylpropyl]-phenyl-silyl]propylsulfanyl]oxan-3-yl]oxy-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-[3-[bis[3-[(2S,3R,4R,5S,6R)-3-acetamido-4-acetyloxy-6-(acetyloxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylpropyl]-phenyl-silyl]propylsulfanyl]oxan-3-yl]oxy-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-acetoxy-2-(acetoxymethyl)-6-[3-[bis[3-[(2S,3R,4R,5S,6R)-3-acetamido-4-acetoxy-6-(acetoxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylpropyl]-phenyl-silyl]propylsulfanyl]tetrahydropyran-3-yl]oxy-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4S,5R,6S)-6-[[(2R,3S,4R,5R,6S)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-[3-[bis[3-[[(2S,3R,4R,5S,6R)-3-acetamido-4-acetyloxy-6-(acetyloxymethyl)-5-[[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]propyl]-phenylsilyl]propylthio]-3-oxanyl]oxy]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-acetyloxy-2-(acetyloxymethyl)-6-[3-[bis[3-[(2S,3R,4R,5S,6R)-3-acetamido-4-acetyloxy-6-(acetyloxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylpropyl]-phenylsilyl]propylsulfanyl]oxan-3-yl]oxy-3,4,5-triacetyloxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-4-acetoxy-2-(acetoxymethyl)-6-[3-[bis[3-[[(2S,3R,4R,5S,6R)-3-acetamido-4-acetoxy-6-(acetoxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]thio]propyl]-phenyl-silyl]propylthio]tetrahydropyran-3-yl]oxy-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl ester Formula: C93H131N3O48S3Si MolecularWeight: 2183.30704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1SCCC[Si](CCCSC2C(C(C(C(O2)COC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)(CCCSC4C(C(C(C(O4)COC(=O)C)OC5C(C(C(C(O5)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)C6=CC=CC=C6)COC(=O)C)OC7C(C(C(C(O7)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1SCCC[Si](CCCS[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)(CCCS[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)C)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)C6=CC=CC=C6)COC(=O)C)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C93H131N3O48S3Si/c1-42(97)94-70-79(127-54(13)109)73(142-88-85(133-60(19)115)82(130-57(16)112)76(124-51(10)106)64(136-88)36-118-45(4)100)67(39-121-48(7)103)139-91(70)145-30-25-33-148(63-28-23-22-24-29-63,34-26-31-146-92-71(95-43(2)98)80(128-55(14)110)74(68(140-92)40-122-49(8)104)143-89-86(134-61(20)116)83(131-58(17)113)77(125-52(11)107)65(137-89)37-119-46(5)101)35-27-32-147-93-72(96-44(3)99)81(129-56(15)111)75(69(141-93)41-123-50(9)105)144-90-87(135-62(21)117)84(132-59(18)114)78(126-53(12)108)66(138-90)38-120-47(6)102/h22-24,28-29,64-93H,25-27,30-41H2,1-21H3,(H,94,97)(H,95,98)(H,96,99)/t64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76+,77+,78+,79-,80-,81-,82+,83+,84+,85-,86-,87-,88+,89+,90+,91+,92+,93+/m1/s1