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| Product_Name: | (1R,2R)-N-[[[6-(2-羧基-2,3-二氢-1H-异吲哚-4-基)-2,2-二甲基己基]氧]羰基]-3-甲基-L-缬氨酰-(4R)-4-羟基-L-脯氨酰-1-氨基-N-(环丙基磺酰基)-2-乙基环丙甲酰胺 (1-2)-内酯 |
| CAS: | 923590-37-8 |
| 中文同义词: | (1R,2R)-N-[[[6-(2-羧基-2,3-二氢-1H-异吲哚-4-基)-2,2-二甲基己基]氧]羰基]-3-甲基-L-缬氨酰-(4R)-4-羟基-L-脯氨酰-1-氨基-N-(环丙基磺酰基)-2-乙基环丙甲酰胺 (1-2)-内酯 |
| EnglishSynonyms: | VANIPREVIR ; (1R,2R)-N-[[[6-(2-CARBOXY-2,3-DIHYDRO-1H-ISOINDOL-4-YL)-2,2-DIMETHYLHEXYL]OXY]CARBONYL]-3-METHYL-L-VALYL-(4R)-4-HYDROXY-L-PROLYL-1-AMINO-N-(CYCLOPROPYLSULFONYL)-2-ETHYLCYCLOPROPANECARBOXAMIDE (1-2)-LACTONE |
| pro_mdlNumber: | MFCD16038911 |
| pro_acceptors: | 14 |
| pro_donors: | 3 |
| pro_smile: | CC[C@H]1C[C@@]1(C(=O)NS(=O)(=O)C2CC2)NC(=O)[C@@H]3C[C@@H]4CN3C(=O)[C@@H](NC(=O)OCC(CCCCc5cccc6c5CN(C6)C(=O)O4)(C)C)C(C)(C)C |
| InChi: | InChI=1S/C38H55N5O9S/c1-7-25-18-38(25,33(46)41-53(49,50)27-14-15-27)40-31(44)29-17-26-20-43(29)32(45)30(36(2,3)4)39-34(47)51-22-37(5,6)16-9-8-11-23-12-10-13-24-19-42(21-28(23)24)35(48)52-26/h10,12-13,25-27,29-30H,7-9,11,14-22H2,1-6H3,(H,39,47)(H,40,44)(H,41,46)/t25-,26+,29-,30+,38+/m0/s1 |
| InChiKey: | InChIKey=KUQWGLQLLVFLSM-CXMMALMNSA-N |
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