[(2R,3R,4S,5S,6R)-3-acetyloxy-2-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-oxan-4-yl] ethanoate

Systemtic Name: [(2R,3R,4S,5S,6R)-3-acetyloxy-2-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-oxan-4-yl] ethanoate Openeye Name: [(2R,3R,4S,5S,6R)-3-acetoxy-2-methoxy-6-(p-tolylsulfonyloxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-4-yl] acetate CAS Name: acetic acid [(2R,3R,4S,5S,6R)-3-acetyloxy-2-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]-5-[[(2R,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]oxy]-4-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6R)-3-acetyloxy-2-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxyoxan-4-yl] acetate Traditional Name: acetic acid [(2R,3R,4S,5S,6R)-3-acetoxy-2-methoxy-6-(tosyloxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-4-yl] ester Formula: C52H58O15S MolecularWeight: 955.07292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(C(O2)OC)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)OC)OC(=O)C)OC(=O)C)O[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C52H58O15S/c1-35-25-27-42(28-26-35)68(55,56)62-34-44-46(48(63-36(2)53)50(64-37(3)54)51(57-4)65-44)67-52-49(61-32-41-23-15-8-16-24-41)47(60-31-40-21-13-7-14-22-40)45(59-30-39-19-11-6-12-20-39)43(66-52)33-58-29-38-17-9-5-10-18-38/h5-28,43-52H,29-34H2,1-4H3/t43-,44-,45+,46+,47+,48+,49-,50-,51-,52-/m1/s1