| CAS NO: | 68-19-9 |
| 中文别名 | α-(5,6-Dimethylbenzimidazolyl)cyanocobamide;维生素 B12;维生素Z12;氰钴胺素;VB12/氰钴胺素;α-(5,6-Dimethylbenzimidaz;氰基钴胺;氰钴胺; |
| 英文别名 | Vitamin B12();VB12;Cyanocobalamin|α-(5,6-Dimethylbenzimidazolyl)cyanocobamide|CN-Cbl |
| CAS号 | 68-19-9 |
| SMILES | Cc1cc2c(cc1C)n(cn2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)([O-])O[C@H](C)CNC(=O)CC[C@@]4([C@H]([C@@H]5[C@]6([C@@]([C@@H](/C(=C(/C7=N/C(=C\C8=N/C(=C(\C4=N5)/C)/[C@H](C8(C)C)CCC(=O)N)/[C@H]([C@]7(C)CC(=O)N)CCC(=O)N)\C)/N6[Co+]C#N)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O |
| Inchi | InChI=1S/C62H90N13O14P.CN.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;1-2;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);;/q;;+2/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;;/m1../s1 |
| InchiKey | RMRCNWBMXRMIRW-WZHZPDAFSA-L |
| 分子式 Formula | C63H88CoN14O14P |
| 分子量 Molecular Weight | 1355.37 |
| 熔点 Melting point | >300℃ |
| 储藏条件 Storage conditions | 储存温度2-8℃,充氩保存 |
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