A quantum chemistry investigation on antimalarial mechanism of Qinghaosu based on cleavage of the peroxide bridge / 药学学报
Acta Pharmaceutica Sinica
;
(12): 544-547, 2006.
Artículo
en Chino
| WPRIM
| ID: wpr-271410
ABSTRACT
<p><b>AIM</b>To investigate antimalarial mechanism of Qinghaosu ( QHS) and its derivatives.</p><p><b>METHODS</b>The electronic structure of QHS and its derivatives were completely optimized and calculated at B3LYP/6-31G * level, while the route was at HF/STO-3G level.</p><p><b>RESULTS</b>The peroxide bridge is the active center of QHS and induced by ferrous iron to produce cyclic product.</p><p><b>CONCLUSION</b>Heme can link with QHS derivatives.</p>
Texto completo:
Disponible
Índice:
WPRIM (Pacífico Occidental)
Asunto principal:
Peróxidos
/
Plantas Medicinales
/
Teoría Cuántica
/
Química
/
Artemisia
/
Artemisininas
/
Transporte de Electrón
/
Radicales Libres
/
Hemo
/
Modelos Químicos
Idioma:
Chino
Revista:
Acta Pharmaceutica Sinica
Año:
2006
Tipo del documento:
Artículo
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