Pro_Molecular_Structure:
pro_cdbregno:CCD00249805
乙酰腈,((2-(((3-β,5-α,17-β)-3-羟基雄甾烷-17-基)甲基氨基)乙基)氨基)-,二盐酸
pro_cas:
126054-51-1
pro_formula:C24 H41 N3 O . Cl H
pro_molWeight:424.069
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| Product_Name： | 乙酰腈,((2-(((3-β,5-α,17-β)-3-羟基雄甾烷-17-基)甲基氨基)乙基)氨基)-,二盐酸 |
| CAS： | 126054-51-1 |
| 中文同义词： | 乙酰腈,((2-(((3-β,5-α,17-β)-3-羟基雄甾烷-17-基)甲基氨基)乙基)氨基)-,二盐酸 |
| EnglishSynonyms： | ACETONITRILE, ((2-(((3-BETA,5-ALPHA,17-BETA)-3-HYDROXYANDROSTAN-17-YL) METHYLAMINO)ETHYL)AMINO)-, DIHYDROCHLORIDE |
| pro_mdlNumber： | MFCD01743402 |
| pro_acceptors： | 4 |
| pro_donors： | 2 |
| pro_smile： | C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4N(C)CCNCC#N)C)O.Cl |
| InChi： | InChI=1S/C24H41N3O.ClH/c1-23-10-8-18(28)16-17(23)4-5-19-20-6-7-22(24(20,2)11-9-21(19)23)27(3)15-14-26-13-12-25;/h17-22,26,28H,4-11,13-16H2,1-3H3;1H/t17-,18-,19-,20-,21-,22-,23-,24-;/m0./s1 |
| InChiKey： | InChIKey=IWZNSBKYZSECQQ-DBUGVKGCSA-N |
basic_info
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