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Volumn 126, Issue 6, 2004, Pages 1907-1920

Radical Clock Substrates, Their C-H Hydroxylation Mechanism by Cytochrome P450, and Other Reactivity Patterns: What Does Theory Reveal about the Clocks' Behavior?

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; COMPUTATIONAL METHODS; HYDROXYLATION; METABOLISM; METHANE;

EID: 1242291810     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja039439s     Document Type: Article
Times cited : (157)

References (68)
  • 44
    • 0004160492 scopus 로고    scopus 로고
    • Schrödinger, Inc.: Portland, OR
    • Jaguar 4.1; Schrödinger, Inc.: Portland, OR, 2000.
    • (2000) Jaguar 4.1
  • 50
    • 26344446142 scopus 로고    scopus 로고
    • Ph.D. Thesis, The Heinfich-Heine University Of Düsseldorf, Düsseldorf, Germany
    • cam. Ph.D. Thesis, The Heinfich-Heine University of Düsseldorf, Düsseldorf, Germany, 2003.
    • (2003) cam
    • Schöneboom, J.C.1
  • 51
    • 85039585104 scopus 로고    scopus 로고
    • Part of a Ph.D. Thesis, The Hebrew University, Jerusalem, Israel
    • cam. Part of a Ph.D. Thesis, The Hebrew University, Jerusalem, Israel.
    • cam
    • Cohen, S.1
  • 56
    • 85039581922 scopus 로고    scopus 로고
    • note
    • 2), and the rate constant of C-H hydroxylation. Any other process that branches out from the ES complexes will further affect the expression by changing selectively the concentrations of the protio and/ or deuterio ES complexes.
  • 57
    • 85039581396 scopus 로고    scopus 로고
    • note
    • D) + 1]}. The calculations show that φ is virtually unity.
  • 64
    • 85039588166 scopus 로고    scopus 로고
    • See pages 129-134 in ref 43
    • See pages 129-134 in ref 43.
  • 66
    • 85039583586 scopus 로고    scopus 로고
    • note
    • 2u orbital (the mixing is mediated by the π* orbitals of the FeO moiety). As such, this species is a highly conjugated intimate ion pair, with a preponderant radical character.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.