Chemical Compound

Hydroxocobalamin HCl

CAS Registry Number 78091-12-0
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Hydroxocobalamin HCl chemical structure
Primary Record

Hydroxocobalamin HCl

In stock
8,280 g
Purity
98.9 %
CAS
78091-12-0

Compound Identifiers & Properties

CAS
78091-12-0
PubChem CID
50930249
SMILES
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(=C\7/C(C(/C(=C/C8=N/C(=C(\C4=N5)/C)/C(C8(C)C)CCC(=O)N)/N7)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[OH-].Cl.[Co+3]
Canonical SMILES
C/C1=C2/N=C(/C=C3\N/C(=C(/C)C4=NC(C)(C5N=C1C(C)(CCC(=O)NCC(C)OP(=O)([O-])OC1C(CO)OC(n6cnc7cc(C)c(C)cc76)C1O)C5CC(N)=O)C(C)(CC(N)=O)C4CCC(N)=O)C(C)(CC(N)=O)C3CCC(N)=O)C(C)(C)C2CCC(N)=O.Cl.[Co+3].[OH-]

Names & Synonyms

  • Hydroxocobalamin HCl
  • AC1NUQRY
  • Hydroxocobalamin hydrochloride
  • FH45888
  • FT-0627145
  • 78091-12-0
  • Cobinamide, Co-hydroxy-, f-(dihydrogen phosphate), inner salt, 3'-ester with (5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole-kappaN3),hydrochloride
  • 58288-50-9
  • cobalt(3+); [5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(5Z,10Z,14Z)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-1,2,7,12,17,23-hexahydrocorrin-3-yl]propanoylamino]propan-2-yl phosphate; hydroxide; hydrochloride