Nitrogen inversion barriers affect the N-oxidation of tertiary alkylamines by cytochromes P450
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Nitrogen inversion barriers affect the N-oxidation of tertiary alkylamines by cytochromes P450. / Rydberg, Patrik; Jørgensen, Martin S.; Jacobsen, T.A.; Jacobsen, A.-M.; Madsen, Kim G.; Olsen, L.
In: Angewandte Chemie International Edition, Vol. 52, No. 3, 14.01.2013, p. 993-997.Research output: Contribution to journal › Journal article › Research › peer-review
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TY - JOUR
T1 - Nitrogen inversion barriers affect the N-oxidation of tertiary alkylamines by cytochromes P450
AU - Rydberg, Patrik
AU - Jørgensen, Martin S.
AU - Jacobsen, T.A.
AU - Jacobsen, A.-M.
AU - Madsen, Kim G.
AU - Olsen, L.
PY - 2013/1/14
Y1 - 2013/1/14
N2 - Calculations: Cytochrome P450 enzymes facilitate a number of chemically different reactions. For example, amines can be either N-dealkylated or N-oxidized, but it is complex to rationalize which of these competing reactions occurs. It is shown that the barrier for inversion of the alkylamine nitrogen atom seems to be of vital importance for the amount of N-oxidized product formed relative to dealkylation and hydroxylation products.
AB - Calculations: Cytochrome P450 enzymes facilitate a number of chemically different reactions. For example, amines can be either N-dealkylated or N-oxidized, but it is complex to rationalize which of these competing reactions occurs. It is shown that the barrier for inversion of the alkylamine nitrogen atom seems to be of vital importance for the amount of N-oxidized product formed relative to dealkylation and hydroxylation products.
UR - http://www.scopus.com/inward/record.url?scp=84872328870&partnerID=8YFLogxK
U2 - 10.1002/anie.201206207
DO - 10.1002/anie.201206207
M3 - Journal article
C2 - 23192954
AN - SCOPUS:84872328870
VL - 52
SP - 993
EP - 997
JO - Angewandte Chemie International Edition
JF - Angewandte Chemie International Edition
SN - 1433-7851
IS - 3
ER -
ID: 45249213