basic_info |
|
| Product_Name: | 美勃嗪 |
| CAS: | 3625-07-8 |
| 中文同义词: | 美勃嗪 |
| EnglishSynonyms: | MEBOLAZINE |
| pro_mdlNumber: | MFCD00864185 |
| pro_acceptors: | 4 |
| pro_donors: | 2 |
| pro_smile: | C[C@@H]\1C[C@]2([C@@H](CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)C/C1=N\N=C\5/C[C@@H]6CC[C@H]7[C@@H]8CC[C@]([C@]8(CC[C@@H]7[C@]6(C[C@H]5C)C)C)(C)O)C |
| InChi: | InChI=1S/C42H68N2O2/c1-25-23-37(3)27(9-11-29-31(37)13-17-39(5)33(29)15-19-41(39,7)45)21-35(25)43-44-36-22-28-10-12-30-32(38(28,4)24-26(36)2)14-18-40(6)34(30)16-20-42(40,8)46/h25-34,45-46H,9-24H2,1-8H3/b43-35+,44-36+/t25-,26-,27+,28+,29-,30-,31+,32+,33+,34+,37+,38+,39+,40+,41+,42+/m1/s1 |
| InChiKey: | InChIKey=POPWFGNRCCUJGU-RSSVFQIBSA-N |
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