basic_info |
|
| Product_Name: | SAFRACIN B |
| CAS: | 87578-99-2 |
| EnglishSynonyms: | SAFRACIN B |
| pro_mdlNumber: | MFCD01939882 |
| pro_acceptors: | 11 |
| pro_donors: | 4 |
| pro_smile: | Cc1c2c(cc(c1OC)O)[C@H]3[C@@H]4CC5=C([C@@H](N4[C@H]([C@H](C2)N3C)O)CNC(=O)[C@H](C)N)C(=O)C(=C(C5=O)C)OC |
| InChi: | InChI=1S/C28H36N4O7/c1-11-14-7-18-28(37)32-17(22(31(18)4)15(14)9-20(33)25(11)38-5)8-16-21(19(32)10-30-27(36)13(3)29)24(35)26(39-6)12(2)23(16)34/h9,13,17-19,22,28,33,37H,7-8,10,29H2,1-6H3,(H,30,36)/t13-,17-,18-,19-,22-,28-/m0/s1 |
| InChiKey: | InChIKey=LTBGHQVRFRKHLN-RPZGIMLZSA-N |
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