basic_info |
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Product_Name: | 奥瑞布林 |
CAS: | 181816-48-8 |
中文同义词: | 二环[2.2.1]庚-5-烯-2-羧酸,2-甲基丙基酯, (1R,2R,4R)-rel- ; 奥瑞布林 ; (2S)-2-氨基-3-羟基-N-[2-甲氧基-5-[(1Z)-2-(3,4,5-三甲氧基苯基)乙烯基]苯基]丙酰胺 |
EnglishSynonyms: | (2S)-2-AMINO-3-HYDROXY-N-[2-METHOXY-5-[(1Z)-2-(3,4,5-TRIMETHOXYPHENYL)ETHENYL]PHENYL]PROPANAMIDE ; OMBRABULIN |
pro_mdlNumber: | MFCD00951209 |
pro_acceptors: | 8 |
pro_donors: | 3 |
pro_smile: | COc1ccc(cc1NC(=O)[C@H](CO)N)/C=C\c2cc(c(c(c2)OC)OC)OC |
InChi: | InChI=1S/C21H26N2O6/c1-26-17-8-7-13(9-16(17)23-21(25)15(22)12-24)5-6-14-10-18(27-2)20(29-4)19(11-14)28-3/h5-11,15,24H,12,22H2,1-4H3,(H,23,25)/b6-5-/t15-/m0/s1 |
InChiKey: | InChIKey=IXWNTLSTOZFSCM-YVACAVLKSA-N |
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