basic_info |
|
| Product_Name： | 依卡洛尔 |
| CAS： | 77695-52-4 |
| 中文同义词： | 依卡洛尔 ; 益卡司托 |
| EnglishSynonyms： | ECASTOLOL |
| pro_mdlNumber： | MFCD00868942 |
| pro_acceptors： | 9 |
| pro_donors： | 3 |
| pro_smile： | CCCC(=O)Nc1ccc(c(c1)c2ccno2)OCC(CNCCc3ccc(c(c3)OC)OC)O |
| InChi： | InChI=1S/C26H33N3O6/c1-4-5-26(31)29-19-7-9-22(21(15-19)23-11-13-28-35-23)34-17-20(30)16-27-12-10-18-6-8-24(32-2)25(14-18)33-3/h6-9,11,13-15,20,27,30H,4-5,10,12,16-17H2,1-3H3,(H,29,31) |
| InChiKey： | InChIKey=CGUIWXDBHIFQJV-UHFFFAOYSA-N |
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