基本信息 |
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产品名称: | STREPTONICOZID |
CAS: | 5667-71-0 |
英文同义词: | STREPTONICOZID |
MDL号: | MFCD00864974 |
氢键受体数量: | 22 |
氢键供体数量: | 15 |
Smile: | C[C@@H]1[C@]([C@@H]([C@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)NC(=N)N)O)NC(=N)N)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC)(/C=N\NC(=O)c4ccncc4)O |
InChi: | InChI=1S/C27H44N10O12/c1-9-27(45,8-34-37-22(44)10-3-5-33-6-4-10)21(49-23-14(32-2)18(42)15(39)11(7-38)47-23)24(46-9)48-20-13(36-26(30)31)16(40)12(35-25(28)29)17(41)19(20)43/h3-6,8-9,11-21,23-24,32,38-43,45H,7H2,1-2H3,(H,37,44)(H4,28,29,35)(H4,30,31,36)/b34-8-/t9-,11-,12-,13+,14-,15-,16-,17+,18-,19-,20-,21-,23-,24-,27+/m1/s1 |
InChiKey: | InChIKey=JCBKYEIGGFKWPQ-IIBMGXBWSA-N |
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