Primary Record
cyanocobalamin
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 6604202
- SMILES
- CC1=CC2=C(C=C1C)N(C=N2)[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)/[N-]6)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[C-]#N.[Co+3]
- Canonical SMILES
- C/C1=C2/N=C(/C=C3\N=C(/C(C)=C4\[N-][C@@](C)([C@H]5N=C1[C@@](C)(CCC(=O)NC[C@H](C)OP(=O)([O-])O[C@@H]1[C@H](O)[C@H](n6cnc7cc(C)c(C)cc76)O[C@@H]1CO)[C@@H]5CC(N)=O)[C@](C)(CC(N)=O)[C@H]4CCC(N)=O)[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)C(C)(C)[C@@H]2CCC(N)=O.[C-]#N.[Co+3]
Names & Synonyms
- cyanocobalamin
- CID6604202
- CAS-68-19-9
- NCGC00016302-01