Chemical Compound

Hydroxocobalamin hydrochloride

CAS Registry Number 58288-50-9
Hydroxocobalamin hydrochloride chemical structure
Primary Record

Hydroxocobalamin hydrochloride

In stock
8,968 g
Purity
99.3 %
CAS
58288-50-9

Compound Identifiers & Properties

CAS
58288-50-9
PubChem CID
169441679
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(=N6)C(=C7[C@@]([C@@H](C(=N7)C=C8C([C@@H](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.O.Cl.[Co+2]
Canonical SMILES
CC1=C2[N-][C@H]([C@H](CC(N)=O)[C@@]2(C)CCC(=O)NC[C@@H](C)OP(=O)([O-])O[C@H]2[C@@H](O)[C@@H](n3cnc4cc(C)c(C)cc43)O[C@@H]2CO)[C@]2(C)N=C(C(C)=C3N=C(C=C4N=C1[C@@H](CCC(N)=O)C4(C)C)[C@@H](CCC(N)=O)[C@]3(C)CC(N)=O)[C@@H](CCC(N)=O)[C@]2(C)CC(N)=O.Cl.O.[Co+2]

Names & Synonyms

  • Hydroxocobalamin hydrochloride
  • Hydroxocobalamin Hydrochloride (>85%)
  • 58288-50-9
  • Hydroxocobalamin chloride; Coa-[a-(5,6-dimethylbenzimidazolyl)]-Coss-hydroxocobamide chloride; Cobinamide, Co-hydroxy-, f-(dihydrogen phosphate), inner salt, 3'-ester with (5,6-dimethyl-1-a-D-ribofuranosyl-1H-benzimidazole-?N3), hydrochloride (9CI); Cobinamide, dihydroxide, dihydrogen phosphate (ester), mono(inner salt), 3'-ester with 5,6-dimethyl-1-a-D-ribofuranosyl-1H-benzimidazole, hydrochloride; Hydroxocobalamin hydrochloride