[(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-5-oxidanyl-6-(phenylmethoxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-5-oxidanyl-6-(phenylmethoxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-4,5-diacetoxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetoxy-6-(benzyloxymethyl)-5-hydroxy-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-5-hydroxy-6-(phenylmethoxymethyl)-2-oxanyl]oxymethyl]-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-5-hydroxy-6-(phenylmethoxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-4,5-diacetoxy-6-[(R)-cyano(phenyl)methoxy]-2-[[(2R,3R,4S,5R,6R)-3,4-diacetoxy-6-(benzoxymethyl)-5-hydroxy-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-3-yl] ester Formula: C37H43NO16 MolecularWeight: 757.73442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)OC(C#N)C2=CC=CC=C2)COC3C(C(C(C(O3)COCC4=CC=CC=C4)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)O[C@@H](C#N)C2=CC=CC=C2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COCC4=CC=CC=C4)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C37H43NO16/c1-20(39)47-31-29(54-37(35(51-24(5)43)33(31)49-22(3)41)52-27(16-38)26-14-10-7-11-15-26)19-46-36-34(50-23(4)42)32(48-21(2)40)30(44)28(53-36)18-45-17-25-12-8-6-9-13-25/h6-15,27-37,44H,17-19H2,1-5H3/t27-,28+,29+,30+,31+,32-,33-,34+,35+,36+,37+/m0/s1