[(3R,4S,5R)-4,6-diacetyloxy-5-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-3-yl] benzoate

Systemtic Name: [(3R,4S,5R)-4,6-diacetyloxy-5-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-3-yl] benzoate Openeye Name: [(3R,4S,5R)-4,6-diacetoxy-5-[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(3R,4S,5R)-4,6-diacetyloxy-5-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-3-oxanyl] ester IUPAC Name: [(3R,4S,5R)-4,6-diacetyloxy-5-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(3R,4S,5R)-4,6-diacetoxy-5-[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] ester Formula: C30H36O17 MolecularWeight: 668.59664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2C(C(COC2OC(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C)OC(=O)C)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](COC2OC(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C30H36O17/c1-14(31)38-12-22-23(40-15(2)32)25(42-17(4)34)27(43-18(5)35)30(46-22)47-26-24(41-16(3)33)21(13-39-29(26)44-19(6)36)45-28(37)20-10-8-7-9-11-20/h7-11,21-27,29-30H,12-13H2,1-6H3/t21-,22-,23+,24+,25+,26-,27-,29?,30-/m1/s1