[(2R,3R,4S,5R,6S)-3,4,5-tris(acetyloxy)-6-{3-[7,12,17-tris(3-{[(2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenoxy}oxan-2-yl]methyl acetate

化合物标识与属性

PubChem CID

16177905

SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=CC(=C2)C3=C4C=CC(=C(C5=NC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC(=CC=C8)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C1=CC(=CC=C1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C=C5)C1=CC(=CC=C1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)N4)OC(=O)C)OC(=O)C)OC(=O)C

Canonical SMILES

CC(=O)OC[C@H]1O[C@@H](Oc2cccc(-c3c4nc(c(-c5cccc(O[C@@H]6O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]6OC(C)=O)c5)c5ccc([nH]5)c(-c5cccc(O[C@@H]6O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]6OC(C)=O)c5)c5nc(c(-c6cccc(O[C@@H]7O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]7OC(C)=O)c6)c6ccc3[nH]6)C=C5)C=C4)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O