138564-59-7 Purity
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Specification
The PubChem CID of 5-Deoxyadenosylcobalamin is 6436143.
The molecular formula of 5-Deoxyadenosylcobalamin is C72H100CoN18O17P.
The synonyms for 5-Deoxyadenosylcobalamin include Cobamamide, Dibencozide, Funacomide, Calomide, and adenosylcobalamin.
The molecular weight of 5-Deoxyadenosylcobalamin is 1579.6 g/mol.
The parent compound of 5-Deoxyadenosylcobalamin is CID 3034082.
5-Deoxyadenosylcobalamin is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). It is one of two metabolically active forms synthesized upon ingestion of vitamin B12 and is the predominant form in the liver. It acts as a coenzyme in the reaction catalyzed by methylmalonyl-CoA mutase.
5-Deoxyadenosylcobalamin acts as a coenzyme in the reaction catalyzed by methylmalonyl-CoA mutase.
Adenosylcobalamin deficiency can cause methylmalonic acidemia and metabolic acidosis.
The InChIKey of 5-Deoxyadenosylcobalamin is OAJLVMGLJZXSGX-VCABRDNDSA-L.
The canonical SMILES of 5-Deoxyadenosylcobalamin is CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=N6)C(=C7C(C(C(=N7)C=C8C(C(C(=N8)C(=C4[N-]5)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.[CH2-]C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.[Co+3].