(2R,4aR,6S,7S,8S,8aS)-6-[(2R,3R,4S,5R,6R)-6-octoxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol

Systemtic Name: (2R,4aR,6S,7S,8S,8aS)-6-[(2R,3R,4S,5R,6R)-6-octoxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Openeye Name: (2R,4aR,6S,7S,8S,8aS)-7-benzyloxy-6-[(2R,3R,4S,5R,6R)-4,5-dibenzyloxy-2-(benzyloxymethyl)-6-octoxy-tetrahydropyran-3-yl]oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol CAS Name: (2R,4aR,6S,7S,8S,8aS)-6-[[(2R,3R,4S,5R,6R)-6-octoxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3-oxanyl]oxy]-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol IUPAC Name: (2R,4aR,6S,7S,8S,8aS)-6-[(2R,3R,4S,5R,6R)-6-octoxy-4,5-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxan-3-yl]oxy-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Traditional Name: (2R,4aR,6S,7S,8S,8aS)-7-benzoxy-6-[(2R,3R,4S,5R,6R)-4,5-dibenzoxy-2-(benzoxymethyl)-6-octoxy-tetrahydropyran-3-yl]oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Formula: C55H66O11 MolecularWeight: 903.10594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1C(C(C(C(O1)COCC2=CC=CC=C2)OC3C(C(C4C(O3)COC(O4)C5=CC=CC=C5)O)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8

Isomeric SMILES

CCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)O[C@H]3[C@H]([C@H]([C@H]4[C@H](O3)CO[C@H](O4)C5=CC=CC=C5)O)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8

InChI

InChI=1S/C55H66O11/c1-2-3-4-5-6-22-33-58-54-52(61-37-43-29-18-10-19-30-43)51(60-36-42-27-16-9-17-28-42)49(45(63-54)38-57-34-40-23-12-7-13-24-40)66-55-50(59-35-41-25-14-8-15-26-41)47(56)48-46(64-55)39-62-53(65-48)44-31-20-11-21-32-44/h7-21,23-32,45-56H,2-6,22,33-39H2,1H3/t45-,46-,47+,48-,49-,50+,51+,52-,53-,54-,55+/m1/s1