Products 68141-45-7

CAS 68141-45-7 appears in our catalog under these names: NADP monopotassium salt, b-Nicotinamide adenine dinucleotide phosphate potassium salt hydrate. Offered by: GLPBio, Biosynth. Available pack sizes: 250mg, 50mg, 100g.

Structural formula: {0} (CAS {1})

Potassium [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate (CAS 68141-45-7) is a chemical compound with the molecular formula C21H27KN7O17P3 and a molecular weight of 781.5 g/mol. IUPAC name: potassium [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate. InChIKey: YUTBYWSDZWYADH-QYZPTAICSA-M.

Identity
Molecular formulaC21H27KN7O17P3
Molecular weight781.5 g/mol
IUPAC namepotassium [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
InChIKeyYUTBYWSDZWYADH-QYZPTAICSA-M
SMILESC1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N.[K+]

Computed by PubChem (NCBI)