A188028
Acetyl Vitamin B12 (>85%)
| Trivial name | Acetyl Vitamin B12 (>85%) |
| Catalog Number | TRC-A188028-100MG |
| Alternative Name(s) | Coβ-cyano-O5R-acetylcobalamin; |
| Molecular Formula | C₆₅H₉₀CoN₁₄O₁₅P |
| CAS# | 855207-36-2 |
| Inchi | InChI=1S/C64H92N13O15P.CN.Co/c1-30-21-41-42(22-31(30)2)77(29-72-41)59-54(86)55(43(90-59)28-89-35(6)78)92-93(87,88)91-32(3)27-71-51(85)19-20-61(9)39(23-48(68)82)58-64(12)63(11,26-50(70)84)38(15-18-47(67)81)53(76-64)34(5)57-62(10,25-49(69)83)36(13-16-45(65)79)40(73-57)24-44-60(7,8)37(14-17-46(66)80)52(74-44)33(4)56(61)75-58;1-2;/h21-22,24,29,32,36-39,43,54-55,58-59,86H,13-20,23,25-28H2,1-12H3,(H15,65,66,67,68,69,70,71,73,74,75,76,79,80,81,82,83,84,85,87,88);;/q;-1;+3/p-2 |
| SMILES | NC(CC1(C(C2=N/C1=C(C3=NC(C)(C(C)(C3CCC(N)=O)CC(N)=O)C([N-]/C4=C(C(C(C(C)/5C)CCC(N)=O)=NC5=C/2)/C)C(C4(C)CCC(NCC(C)OP(O[C@H]6[C@H]([C@H](O[C@@H]6COC(C)=O)N7C=[N+](C8=C7C=C(C(C)=C8)C)[Co+]C#N)O)([O-])=O)=O)CC(N)=O)/C)CCC(N)=O)C)=O |
| Beilstein Registry Number | NA |
| Size | 100mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-A188028-100MG |