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| Standard English name | |
|---|---|
| Cas No. | |
| Alias | 1-((2R,4S,5R)-5-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-hydroxytetrahydrofuran-2-yl)-5-((4-((4-((4-((3-methyl-4-((4-((2-(pyridin-4-yl)ethyl)thio)phenyl)ethynyl)phenyl)ethynyl)phenyl)ethynyl)-2,5-dipropoxyphenyl)ethynyl)phenyl)ethynyl)pyrimidine-2,4(1H,3H)-dione |
| Canonical Smiles | CC1=CC(=CC=C1C#CC1C=CC(=CC=1)SCCC1C=CN=CC=1)C#CC1C=CC(=CC=1)C#CC1C=C(OCCC)C(=CC=1OCCC)C#CC1C=CC(=CC=1)C#CC1=CN([C@H]2C[C@H](O)[C@@H](COC(C3C=CC=CC=3)(C3C=CC(=CC=3)OC)C3C=CC(=CC=3)OC)O2)C(=O)NC1=O |
| MDL No. | |
| Exact Mass | 1,297.49110 |
| Smiles | O[C@@H](C[C@H](N1C(NC(C(C#CC2=CC=C(C#CC3=CC(OCCC)=C(C#CC4=CC=C(C#CC5=CC=C(C#CC6=CC=C(SCCC7=CC=NC=C7)C=C6)C(C)=C5)C=C4)C=C3OCCC)C=C2)=C1)=O)=O)O8)[C@H]8COC(C9=CC=C(OC)C=C9)(C%10=CC=C(OC)C=C%10)C%11=CC=CC=C%11 |
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| Inchi | InChI=1S/C84H71N3O9S/c1-6-50-93-78-55-69(79(94-51-7-2)54-68(78)32-24-61-15-13-60(14-16-61)21-22-66-27-31-67(59(3)53-66)30-23-64-28-43-76(44-29-64)97-52-47-65-45-48-85-49-46-65)33-25-62-17-19-63(20-18-62)26-34-70-57-87(83(90)86-82(70)89)81-56-77(88)80(96-81)58-95-84(71-11-9-8-10-12-71,72-35-39-74(91-4)40-36-72)73-37-41-75(92-5)42-38-73/h8-20,27-29,31,35-46,48-49,53-55,57,77,80-81,88H,6-7,47,50-52,56,58H2,1-5H3,(H,86,89,90)/t77-,80+,81+/m0/s1 |
| InchiKey | HMGPEKUSIGNELF-LYROGXCLSA-N |
| Remark |
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