Title : Tautomeric equilibria of pyridoxal-5'-phosphate (vitamin B6) and 3-hydroxypyridine derivatives: a theoretical study of solvation effects.

Pub. Date : 2003 Apr 4

PMID : 12662064






1 Functional Relationships(s)
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1 The tautomeric equilibria of a series of 3-hydroxypyridine derivatives including pyridoxal-5"-phosphate (PLP), the active form of vitamin B(6), have been studied using density functional calculations (B3LYP/6-311+G//B3LYP/6-31G) in the gas phase and in different solvents. Niacinamide pyridoxal phosphatase Homo sapiens