basic_info |
|
| Product_Name: | BOMETOLOL |
| CAS: | 65008-93-7 |
| EnglishSynonyms: | BOMETOLOL |
| pro_mdlNumber: | MFCD00864579 |
| pro_acceptors: | 9 |
| pro_donors: | 3 |
| pro_smile: | CC(=O)COc1ccc(c2c1NC(=O)CC2)OCC(CNCCc3ccc(c(c3)OC)OC)O |
| InChi: | InChI=1S/C25H32N2O7/c1-16(28)14-33-22-8-7-20(19-5-9-24(30)27-25(19)22)34-15-18(29)13-26-11-10-17-4-6-21(31-2)23(12-17)32-3/h4,6-8,12,18,26,29H,5,9-11,13-15H2,1-3H3,(H,27,30) |
| InChiKey: | InChIKey=IXJJPGSXJXQFGI-UHFFFAOYSA-N |
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