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Volumn 52, Issue 48, 1996, Pages 15209-15224

Preparation of cis-5-methoxy-and-7-methoxy-1-acetoxy-1,2,3,4,4a,10a- hexahydro-9(10H)-phenanthrenone. An epoxide-arene reaction involving a selective 1,2-alkyl shift rearrangement

Author keywords

[No Author keywords available]

Indexed keywords

PHENANTHRENE DERIVATIVE;

EID: 20244387549     PISSN: 00404020     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0040-4020(96)00927-1     Document Type: Article
Times cited : (3)

References (42)
  • 1
    • 0026955823 scopus 로고
    • The utility of side-chain cyclization in determining the receptor-bound conformation of peptides: Cyclic tripeptides and angiotensin II
    • 1. Kataoka, T.; Beusen, D. D.; John D. Clark; Yodo, M.; Marshall, G. R. Biopolymers 1992, 32, 1519-1533. The Utility of Side-Chain Cyclization in Determining the Receptor-Bound Conformation of Peptides: Cyclic Tripeptides and Angiotensin II
    • (1992) Biopolymers , vol.32 , pp. 1519-1533
    • Kataoka, T.1    Beusen, D.D.2    Clark, J.D.3    Yodo, M.4    Marshall, G.R.5
  • 6
    • 0011979782 scopus 로고    scopus 로고
    • Conformational analysis of 1 (using the Amber* all atom force field) and 3 and 4 (using the MM2* force field) was performed using the Systematic Unbound Multiple Minimum search (SUMM) option in the batchmin program (command SPMC). 5000-step runs were performed, and those conformations within 50 kJ/mol of the global minimum was kept. Truncated Newton Conjugated Gradient (TNCG) minimisation with a maximum of 5000 iterations was used in the Monte Carlo search with the default derivate convergence criteria used (0.05 kJ/Å-mol). All torsion angles except the amide bonds, which were set in the trans configuration, were defined as rotatable
    • 6. Conformational analysis of 1 (using the Amber* all atom force field) and 3 and 4 (using the MM2* force field) was performed using the Systematic Unbound Multiple Minimum search (SUMM) option in the batchmin program (command SPMC). 5000-step runs were performed, and those conformations within 50 kJ/mol of the global minimum was kept. Truncated Newton Conjugated Gradient (TNCG) minimisation with a maximum of 5000 iterations was used in the Monte Carlo search with the default derivate convergence criteria used (0.05 kJ/Å-mol). All torsion angles except the amide bonds, which were set in the trans configuration, were defined as rotatable.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.