methyl (2S,3S,4S,5R,6R)-3-[(2S,3R,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-[2,2,2-tris(chloranyl)ethanoylamino]oxan-2-yl]oxy-6-methoxy-4,5-bis(phenylcarbonyloxy)oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4S,5R,6R)-3-[(2S,3R,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-[2,2,2-tris(chloranyl)ethanoylamino]oxan-2-yl]oxy-6-methoxy-4,5-bis(phenylcarbonyloxy)oxane-2-carboxylate Openeye Name: methyl (2S,3S,4S,5R,6R)-4,5-dibenzoyloxy-3-[(2S,3R,4R,5R,6R)-4,5-diacetoxy-6-(acetoxymethyl)-3-[(2,2,2-trichloroacetyl)amino]tetrahydropyran-2-yl]oxy-6-methoxy-tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4S,5R,6R)-4,5-dibenzoyloxy-3-[[(2S,3R,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-[(2,2,2-trichloro-1-oxoethyl)amino]-2-oxanyl]oxy]-6-methoxy-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4S,5R,6R)-4,5-dibenzoyloxy-3-[(2S,3R,4R,5R,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-[(2,2,2-trichloroacetyl)amino]oxan-2-yl]oxy-6-methoxyoxane-2-carboxylate Traditional Name: (2S,3S,4S,5R,6R)-4,5-dibenzoyloxy-3-[(2S,3R,4R,5R,6R)-4,5-diacetoxy-6-(acetoxymethyl)-3-[(2,2,2-trichloroacetyl)amino]tetrahydropyran-2-yl]oxy-6-methoxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C36H38Cl3NO17 MolecularWeight: 863.04242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2C(C(C(OC2C(=O)OC)OC)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)NC(=O)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2C(=O)OC)OC)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)NC(=O)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C36H38Cl3NO17/c1-17(41)50-16-22-24(51-18(2)42)25(52-19(3)43)23(40-35(47)36(37,38)39)33(53-22)56-26-27(54-30(44)20-12-8-6-9-13-20)29(34(49-5)57-28(26)32(46)48-4)55-31(45)21-14-10-7-11-15-21/h6-15,22-29,33-34H,16H2,1-5H3,(H,40,47)/t22-,23-,24+,25-,26+,27+,28+,29-,33+,34-/m1/s1