Oxidation of tertiary amines by cytochrome P450-Kinetic isotope effect as a spin-state reactivity probe

Chemistry - A European Journal

Volumn 15, Issue 34, 2009, Pages 8492-8503

  Li, Chunsen ^a   Wu, Wei ^a   Cho, Kyung Bin ^b   Shaik, Sason ^b   Li, C ^a   Wu, W ^a  

^a XIAMEN UNIVERSITY   (China)

^b HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

Amine oxidation cytochrome P450; Density functional calculations; Kinetic isotope effects; Spin selectivity

Indexed keywords

ALIPHATIC AMINES; AMINE OXIDATION CYTOCHROME P450; AROMATIC AMINES; BOND DISSOCIATION ENERGIES; COMPOUND I; COMPUTATIONAL RESULTS; CYTOCHROME P450; DEALKYLATION; DENSITY FUNCTIONAL CALCULATIONS; EXPERIMENTAL DATA; HYBRID DFT; HYDROGEN ABSTRACTION; KINETIC ISOTOPE EFFECTS; NON-ENZYMATIC; OXO DERIVATIVES; OXYGEN DONORS; RATE-CONTROLLING; REVERSE REACTIONS; SENSITIVE PROBE; SPIN SELECTIVITY; SPIN STATE; TERTIARY AMINE; TRIMETHYLAMINE;

AMINATION; AROMATIC COMPOUNDS; CARRIER MOBILITY; DENSITY FUNCTIONAL THEORY; HYDROGEN; ISOTOPES; OXIDATION; OXYGEN; OXYGENATION; OXYGENATORS; PORPHYRINS; PROBES; SPIN DYNAMICS; SULFUR COMPOUNDS; THERMOANALYSIS;

AMINES;

AMINE; ANILINE DERIVATIVE; CYTOCHROME P450; ISOTOPE; METHYLAMINE; N,N DIMETHYLANILINE; N,N-DIMETHYLANILINE; TRIMETHYLAMINE;

ARTICLE; CATALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; DEALKYLATION; HYDROGEN BOND; KINETICS; OXIDATION REDUCTION REACTION;

AMINES; ANILINE COMPOUNDS; CATALYSIS; COMPUTER SIMULATION; CYTOCHROME P-450 ENZYME SYSTEM; DEALKYLATION; HYDROGEN BONDING; ISOTOPES; KINETICS; METHYLAMINES; MODELS, MOLECULAR; OXIDATION-REDUCTION;

EID: 69249141050     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200802215     Document Type: Article

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