Products 221169-12-6

CAS 221169-12-6 is the registry number for Diquafosol Impurity 6. Offered by: Chemat Brand. Available pack sizes: on request.

Diquafosol Impurity 6
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

Disodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate (CAS 221169-12-6) is a chemical compound with the molecular formula C18H22N4Na2O17P2 and a molecular weight of 674.3 g/mol. IUPAC name: disodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate. InChIKey: GYTOMCACVJADLS-NANZCHBRSA-L.

Identity
Molecular formulaC18H22N4Na2O17P2
Molecular weight674.3 g/mol
IUPAC namedisodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
InChIKeyGYTOMCACVJADLS-NANZCHBRSA-L
SMILESC1=CN(C(=O)NC1=O)[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=CC(=O)NC4=O)O)O)O)O.[Na+].[Na+]

Computed by PubChem (NCBI)

Synonyms: Diquafosol Impurity 3, 221169-12-626184-65-6free base