(2R,4aR,7R,8S,8aR)-6-[(2R,3R,4S,5R,6R)-4,5-bis[(4-methoxyphenyl)methoxy]-6-[(4-methoxyphenyl)methoxymethyl]-2-[(2S)-undec-9-yn-2-yl]oxy-oxan-3-yl]oxy-2-(4-methoxyphenyl)-7,8-bis[(4-methoxyphenyl)methoxy]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine

Systemtic Name: (2R,4aR,7R,8S,8aR)-6-[(2R,3R,4S,5R,6R)-4,5-bis[(4-methoxyphenyl)methoxy]-6-[(4-methoxyphenyl)methoxymethyl]-2-[(2S)-undec-9-yn-2-yl]oxy-oxan-3-yl]oxy-2-(4-methoxyphenyl)-7,8-bis[(4-methoxyphenyl)methoxy]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine Openeye Name: (2R,4aR,7R,8S,8aR)-6-[(2R,3R,4S,5R,6R)-4,5-bis[(4-methoxyphenyl)methoxy]-6-[(4-methoxyphenyl)methoxymethyl]-2-[(1S)-1-methyldec-8-ynoxy]tetrahydropyran-3-yl]oxy-2-(4-methoxyphenyl)-7,8-bis[(4-methoxyphenyl)methoxy]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine CAS Name: (2R,4aR,7R,8S,8aR)-6-[[(2R,3R,4S,5R,6R)-4,5-bis[(4-methoxyphenyl)methoxy]-6-[(4-methoxyphenyl)methoxymethyl]-2-[(2S)-undec-9-yn-2-yl]oxy-3-oxanyl]oxy]-2-(4-methoxyphenyl)-7,8-bis[(4-methoxyphenyl)methoxy]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin IUPAC Name: (2R,4aR,7R,8S,8aR)-6-[(2R,3R,4S,5R,6R)-4,5-bis[(4-methoxyphenyl)methoxy]-6-[(4-methoxyphenyl)methoxymethyl]-2-[(2S)-undec-9-yn-2-yl]oxyoxan-3-yl]oxy-2-(4-methoxyphenyl)-7,8-bis[(4-methoxyphenyl)methoxy]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine Traditional Name: (2R,4aR,7R,8S,8aR)-2-(4-methoxyphenyl)-6-[(2R,3R,4S,5R,6R)-2-[(1S)-1-methyldec-8-ynoxy]-4,5-bis(p-anisyloxy)-6-(p-anisyloxymethyl)tetrahydropyran-3-yl]oxy-7,8-bis(p-anisyloxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin Formula: C71H86O17 MolecularWeight: 1211.43234

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCCCCCC(C)OC1C(C(C(C(O1)COCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC)OC5C(C(C6C(O5)COC(O6)C7=CC=C(C=C7)OC)OCC8=CC=C(C=C8)OC)OCC9=CC=C(C=C9)OC

Isomeric SMILES

CC#CCCCCCC[C@H](C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC)OC5[C@@H]([C@H]([C@H]6[C@H](O5)CO[C@H](O6)C7=CC=C(C=C7)OC)OCC8=CC=C(C=C8)OC)OCC9=CC=C(C=C9)OC

InChI

InChI=1S/C71H86O17/c1-9-10-11-12-13-14-15-16-48(2)84-71-68(65(80-43-51-21-33-57(74-5)34-22-51)63(79-42-50-19-31-56(73-4)32-20-50)61(85-71)46-78-41-49-17-29-55(72-3)30-18-49)88-70-67(82-45-53-25-37-59(76-7)38-26-53)66(81-44-52-23-35-58(75-6)36-24-52)64-62(86-70)47-83-69(87-64)54-27-39-60(77-8)40-28-54/h17-40,48,61-71H,11-16,41-47H2,1-8H3/t48-,61+,62+,63+,64+,65-,66-,67+,68+,69+,70?,71+/m0/s1