methyl (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-7,8-dibenzyloxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(benzyloxycarbonylamino)butanoate CAS Name: (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-2-phenyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S,3R)-3-[[(2R,4aR,6R,7S,8S,8aR)-7,8-dibenzoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-2-(benzyloxycarbonylamino)butyric acid methyl ester Formula: C40H43NO10 MolecularWeight: 697.77012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)OCC1=CC=CC=C1)OC2C(C(C3C(O2)COC(O3)C4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

Isomeric SMILES

C[C@H]([C@@H](C(=O)OC)NC(=O)OCC1=CC=CC=C1)O[C@H]2[C@H]([C@H]([C@H]3[C@H](O2)CO[C@H](O3)C4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C40H43NO10/c1-27(33(37(42)44-2)41-40(43)48-25-30-19-11-5-12-20-30)49-39-36(46-24-29-17-9-4-10-18-29)35(45-23-28-15-7-3-8-16-28)34-32(50-39)26-47-38(51-34)31-21-13-6-14-22-31/h3-22,27,32-36,38-39H,23-26H2,1-2H3,(H,41,43)/t27-,32-,33+,34-,35+,36+,38-,39-/m1/s1