Levcromakalim revisited: NMR spectroscopic and theoretical investigations

Monatshefte fur Chemie

Volumn 132, Issue 3, 2001, Pages 373-386

  Ecker, Gerhard ^a   Kalchhauser, Hermann ^a   Lawtrakul, Luckhana ^a   Wolschann, Peter ^a  

^a UNIVERSITY OF VIENNA   (Austria)

Author keywords

ab initio Calculations; Chemical shifts; Conformation; DFT; GIAO; Levcromakalim; NMR spectroscopy

Indexed keywords

EID: 57249106491     PISSN: 00269247     EISSN: None     Source Type: Journal    
DOI: 10.1007/s007060170123     Document Type: Article

References (35)

1. Pirotte B, de Tullio P (1966) Potassium Channel Modulators ID Research Alert 1: 7
2. Birnbaumer L, Abramowitz J, Yatani A, Okabe K, Mattera R, Graf R, Sanford J, Codina J, Brown AM (1990) Crit Rev Biochem Mol Biol 25: 225
3. Strosberg AD (1991) Eur J Biochem 196: 1
4. Evans JM, Stemp G (1996) Structure-Activity Relationships of Benzopyran Based Potassium Channel Activators. In: Evans JM, Hamilton TC, Longman SD, Stemp G (eds) Potassium Channels and their Modulators: From Synthesis to Clinical Trial. Taylor & Francis, London, Bristol
5. Anonymous (1993) Drugs Fut 18: 278
6. Hiessböck R, Wolf C, Richter E, Hitzler M, Chiba P, Kratzel M, Ecker G (1999) J Med Chem 42: 1921
7. Gericke R, Harting J, Lues I, Schittenhelm C (1991) J Med Chem 34: 3074
8. Cassidy F, Evans JM, Smith DM, Stemp G, Edge C, Williams DJ (1989) J Chem Soc Chem Commun 377
9. Gadwood R, Thomasco L, Groppi V, Burnett B-A, Humphrey SJ, Smith MP, Watt W (1995) Bioorg Med Chem Lett 5: 2101
10. Thomas WA, Whitcombe IWA (1990) J Chem Soc Chem Commun 528
11. Attwood MR, Jones PS, Kay PB, Paciorek PM, Redshaw S (1991) Life Sciences 48: 803
12. Evans JM, Hadley MS, Stemp G (1995) In: Weston AH, Hamilton TC (eds) Frontiers in Pharmacology & Therapeutics: Potassium Channel Modulators. Blackwell, Oxford
13. Wolf C, Weiss-Greiler P, Wolschann P, Ecker G, Fleischhacker W (1966) Pharmazie 51: 836
14. Ecker G, Fleischhacker W, Wolf C, Weiss-Greiler P, Wolschann P (1998) Monatsh Chem 129: 633
15. Kalchhauser H, Robien W (1985) J Chem Inf Comput Sci 25: 103
16. Felsinger S, Kalchhauser H, Neudeck H (2001) Monatsh Chem 132: 267
17. Barfield M, Chakrabarti B (1969) Chem Rev 69: 757 and references cited therein
18. Edwards G, Weston A (1990) TiPS 11: 417
19. Lampert H, Mikenda W, Karpfen A, Kählig H (1997) J Phys Chem 101: 9610
20. GAUSSIAN98 Revision A6 (1998) Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Zakrzewski JA, Montgomery jr JA, Stratmann RE, Burant JC, Dapprich S, Millam JM, Daniels AD, Kudin KN, Strain MC, Farkas O, Tomasi J, Barone V, Cossi M, Cammi R, Mennucci B, Pomelli C, Adamo C, Clifford S, Ochterski J, Petersson GA, Ayala PY, Cui Q, Morokuma K, Malick DK, Rabuck AD, Raghavachari K, Foresman JB, Cioslowski J, Ortiz JV, Stefanov BB, Liu G, Liashenko A, Piskorz P, Komaromi I, Gomperts R, Martin RL, Fox DJ, Keith T, Al-Laham MA, Peng CY, Nanayakkara A, Gonzalez C, Challacombe M, Gill PMW, Johnson B, Chen W, Wong MW, Andres JL, Gonzalez C, Head-Gordon M, Replogle ES, Pople JA; Gaussian Inc. Pittsburgh PA.
21. Cheeseman JR, Trucks GW, Keith TA, Frisch MJ (1996) J Chem Phys 104: 5497
22. Brown DW, Nakashima TT, Rabenstein DL (1981) J Magn Reson 45: 302
23. Davies AL, Laue ED, Keeler J, Moskau D, Lohman J (1991) J Magn Reson 94: 637
24. Shaw AA, Salaun C, Dauphin J-F, Ancian B (1996) J Magn Reson Ser A 120: 110
25. Bax A, Freeman R (1981) J Magn Reson 44: 542
26. Palmer III AG, Cavanagh J, Wright PE, Rance M (1991) J Magn Reson 93: 151
27. Kay LE, Keifer P, Saarinen T (1992) J Amer Chem Soc 114: 10663
28. Schleucher J, Schwendinger M, Sattler M, Schmidt P, Schedletzky O, Glaser SJ, Sørensen OW, Griesinger C (1994) J Biomol NMR 4: 301
29. Kontaxis G, Stonehouse J, Laue ED, Keeler J (1994) J Magn Reson Ser A 111: 70
30. Ruiz-Cabello J, Vuister GW, Moonen CTW, van Gelderen P, Cohen JS, van Zijl PCM (1992) J Magn Reson 100: 282
31. Willker W, Leibfritz D, Kerssebaum R, Bermel W (1993) Magn Reson Chem 31: 287
32. Wagner R, Berger S (1996) J Magn Reson Ser A 123: 119
33. Parella T, Sánchez-Ferrando F, Virgili A (1997) J Magn Reson 125: 145
34. Kählig H (private communication)
35. Bruker, XWINNMR 2.6