Chemical Compound

50-Carboxycyanocobalamin

CAS Registry Number 26264-28-8
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50-Carboxycyanocobalamin chemical structure
Primary Record

50-Carboxycyanocobalamin

In stock
4,224 g
Purity
98.3 %
CAS
26264-28-8

Compound Identifiers & Properties

CAS
26264-28-8
PubChem CID
131635129
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](C5[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\[N-]5)/C)CCC(=O)O)(C)C)CCC(=O)N)(C)CC(=O)N)/C)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@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)=C3\N=C(/C=C4\N=C1[C@@H](CCC(=O)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.[C-]#N.[Co+3]

Names & Synonyms

  • 50-Carboxycyanocobalamin
  • JZ7S5USX27
  • Vitamin B12 e-Monocarboxylic acid
  • COBALAMIN-MONOCARBOXYLIC ACID
  • CYANOCOBALAMIN IMPURITY B [EP IMPURITY]
  • 50-CARBOXYCYANOCOBALAMIN (CONSTITUENT OF CYANOCOBALAMIN) [DSC]
  • Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-cyanocobamic a,b,c,d,g-pentaamide
  • 26264-28-8
  • COBINIC ACID-ABCDG-PENTAMIDE, CO-(CYANO-.KAPPA.C)-, DIHYDROGEN PHOSPHATE (ESTER), INNER SALT, 3'-ESTER WITH (5,6-DIMETHYL-1-.ALPHA.-D-RIBOFURANOSYL-1H-BENZIMIDAZOLE-.KAPPA.N3)
  • COBINIC ACID-ABCDG-PENTAMIDE, CYANIDE HYDROXIDE, DIHYDROGEN PHOSPHATE (ESTER), INNER SALT, 3'-ESTER WITH 5,6-DIMETHYL-1-.ALPHA.-D-RIBOFURANOSYLBENZIMIDAZOLE