Basic Information |
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| Product Name： | COBAMAMIDE |
| CAS： | 13870-90-1 |
| English Synonyms： | 5,6-DIMETHYLBENZIMIDAZOLYLCOBAMIDE COENZYME ; COBINAMIDE, O-(5'-DEOXYADENOSINE-5') DERIV, HYDROXIDE, DIHYDROGEN PHOSPHATE (ESTER), INNER SALT, 3'-ESTER WITH 5,6-DIMETHYL-1-ALPHA-D-RIBOFURANOSYLBENZIMIDAZOLE ; COBAMAMIDE VITAMIN B12 ; 5-DEOXYADENOSYLCOBALAMIN ; COENZYME B12 ; DMBC COENZYME ; COBAMAMIDE ; 5'-DEOXYADENOSYLCOBALAMINE ; ADENOSYL COBALAMIN ; 5'-DEOXYADENOSINE COBAMAMIDE ; DEOXYADENOSYLCOBALAMIN ; COBAMAMIDE/DIBENCOZIDE ; DIMETHYLBENZIMIDAZOLYLCOBAMIDE COENZYME, 5,6- ; COBAMIDE ; DIBENCOZIDE ; ADENOSYL COBALAMINE ; 5'-DEOXYADENOSYLCOBALAMIN |
| MDL Number.： | MFCD00135609 |
| H bond acceptor： | 35 |
| H bond donor： | 12 |
| Smile： | 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(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\N5[Co+]C[C@@H]9[C@@H]([C@@H]([C@H](O9)n1cnc2c1ncnc2N)O)O)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O |
| InChi： | InChI=1S/C62H90N13O14P.C10H12N5O3.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;1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15;/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);2-4,6-7,10,16-17H,1H2,(H2,11,12,13);/q;;+2/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;4-,6+,7+,10+;/m11./s1 |
| InChiKey： | InChIKey=ZIHHMGTYZOSFRC-SLAFOUTOSA-L |
Property |
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Safety information |
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| WGK Germany： | 3 |
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