methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetyloxy-6-[(2S)-3-(3-azidopropylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxidanylidene-propoxy]oxan-2-yl]methoxy]-4-acetyloxy-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate

Systemtic Name: methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetyloxy-6-[(2S)-3-(3-azidopropylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxidanylidene-propoxy]oxan-2-yl]methoxy]-4-acetyloxy-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate Openeye Name: methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetoxy-6-[(2S)-3-(3-azidopropylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxo-propoxy]tetrahydropyran-2-yl]methoxy]-4-acetoxy-6-[(1R,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-carboxylate CAS Name: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetyloxy-6-[(2S)-3-(3-azidopropylamino)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-oxopropoxy]-2-oxanyl]methoxy]-4-acetyloxy-6-[(1R,2R)-1,2,3-triacetyloxypropyl]-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetyloxy-6-[(2S)-3-(3-azidopropylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxopropoxy]oxan-2-yl]methoxy]-4-acetyloxy-6-[(1R,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate Traditional Name: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetoxy-6-[(2S)-3-(3-azidopropylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-keto-propoxy]tetrahydropyran-2-yl]methoxy]-4-acetoxy-6-[(1R,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-carboxylic acid methyl ester Formula: C53H67N7O23 MolecularWeight: 1170.13218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)OCC2C(C(C(C(O2)OCC(C(=O)NCCCN=[N+]=[N-])NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)NC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)OC[C@@H](C(=O)NCCCN=[N+]=[N-])NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)NC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C53H67N7O23/c1-26(61)57-43-40(77-29(4)64)21-53(51(70)72-9,83-48(43)46(80-32(7)67)41(78-30(5)65)24-73-28(3)63)76-25-42-45(79-31(6)66)47(81-33(8)68)44(58-27(2)62)50(82-42)74-23-39(49(69)55-19-14-20-56-60-54)59-52(71)75-22-38-36-17-12-10-15-34(36)35-16-11-13-18-37(35)38/h10-13,15-18,38-48,50H,14,19-25H2,1-9H3,(H,55,69)(H,57,61)(H,58,62)(H,59,71)/t39-,40-,41+,42+,43+,44+,45-,46-,47+,48+,50-,53+/m0/s1