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Volumn 17, Issue 2, 2006, Pages 87-90

The structural elucidation of a novel iridoid derivative from Tachiadenus longiflorus (Gentianaceae) using the LSD programme and quantum chemical computations

Author keywords

Angelone; Coumarins; Gentianaceae; Iridoid; Logic for structure determination programme; NMR; Structure elucidation; Tachiadenus longiflorus

Indexed keywords

COMPUTER CIRCUITS; NUCLEAR MAGNETIC RESONANCE; QUANTUM THEORY;

EID: 33645558699     PISSN: 09580344     EISSN: 10991565     Source Type: Journal    
DOI: 10.1002/pca.890     Document Type: Article
Times cited : (26)

References (16)
  • 2
    • 0000189651 scopus 로고
    • Density-functional thermochemistry. 3. The role of exact exchange
    • Becke AD. 1993. Density-functional thermochemistry. 3. The role of exact exchange. J Chem Phys 98: 5648-5652.
    • (1993) J Chem Phys , vol.98 , pp. 5648-5652
    • Becke, A.D.1
  • 3
    • 1242268874 scopus 로고    scopus 로고
    • A comparison of models for calculating nuclear magnetic resonance shielding tensors
    • Cheeseman JR, Trucks GW, Keith TA, Frisch MJ. 1996. A comparison of models for calculating nuclear magnetic resonance shielding tensors. J Chem Phys 104: 5497-5509.
    • (1996) J Chem Phys , vol.104 , pp. 5497-5509
    • Cheeseman, J.R.1    Trucks, G.W.2    Keith, T.A.3    Frisch, M.J.4
  • 5
    • 0000584523 scopus 로고    scopus 로고
    • Ab initio methods for the calculation of NMR shielding and indirect spin-spin coupling constants
    • Helgaker T, Jaszunski M, Ruud K. 1999. Ab initio methods for the calculation of NMR shielding and indirect spin-spin coupling constants. Chem Rev 99: 293-352.
    • (1999) Chem Rev , vol.99 , pp. 293-352
    • Helgaker, T.1    Jaszunski, M.2    Ruud, K.3
  • 6
    • 85161791189 scopus 로고
    • Gentianaceae and Menyanthaceae bis
    • Muséum National d'Histoires Naturelles: Paris
    • Klackenberg J. 1990. Gentianaceae and Menyanthaceae bis. Flore de Madagascar et des Comores. Muséum National d'Histoires Naturelles: Paris; 168.
    • (1990) Flore De Madagascar Et Des Comores , pp. 168
    • Klackenberg, J.1
  • 7
    • 0345491105 scopus 로고    scopus 로고
    • Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
    • Lee C, Yang W, Parr R. 1998. Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density. Phys Rev B 37: 785-789.
    • (1998) Phys Rev B , vol.37 , pp. 785-789
    • Lee, C.1    Yang, W.2    Parr, R.3
  • 8
    • 0001427147 scopus 로고
    • A triterpene glycoside from the fruits of Tetropleura tetraptera
    • Maillard M, Adewunmi CO, Hostettmann K. 1992. A triterpene glycoside from the fruits of Tetropleura tetraptera. Phytochemistry 31: 1321-1323.
    • (1992) Phytochemistry , vol.31 , pp. 1321-1323
    • Maillard, M.1    Adewunmi, C.O.2    Hostettmann, K.3
  • 9
    • 84987049577 scopus 로고
    • Computer-assisted elucidation of structures of natural products
    • Massiot G, Nuzillard J-M. 1992. Computer-assisted elucidation of structures of natural products. Phytochem Anal 3: 153-159.
    • (1992) Phytochem Anal , vol.3 , pp. 153-159
    • Massiot, G.1    Nuzillard, J.-M.2
  • 11
    • 33645579589 scopus 로고    scopus 로고
    • Automatic structure determination of organic molecules: Principles and implementation of the LSD program
    • Nuzillard J-M. 2003. Automatic structure determination of organic molecules: Principles and implementation of the LSD program. Chin J Chem 21: 1263-1267.
    • (2003) Chin J Chem , vol.21 , pp. 1263-1267
    • Nuzillard, J.-M.1
  • 12
    • 0033578947 scopus 로고    scopus 로고
    • Computer-assisted structural elucidation. Alkaloids with a novel diaza-adamantane skeleton from the seeds of Acosnium panamense (Fabaccae)
    • Nuzillard J-M, Connolly JD, Delaude C, Richard B, Zeches-Hanrot M, Le Men-Olivier L. 1999. Computer-assisted structural elucidation. Alkaloids with a novel diaza-adamantane skeleton from the seeds of Acosnium panamense (Fabaccae). Tetrahedron 55: 11511-11518.
    • (1999) Tetrahedron , vol.55 , pp. 11511-11518
    • Nuzillard, J.-M.1    Connolly, J.D.2    Delaude, C.3    Richard, B.4    Zeches-Hanrot, M.5    Le Men-Olivier, L.6
  • 13
    • 3042546095 scopus 로고
    • Centre National de Recherche Pharmaceutique: Antananarivo
    • Rabesa ZA. 1986. Pharmacopée de l'Alaotra. Centre National de Recherche Pharmaceutique: Antananarivo.
    • (1986) Pharmacopée De L'Alaotra
    • Rabesa, Z.A.1
  • 14
    • 9344269016 scopus 로고
    • Transferable scaling factors for density functional derived vibrational force fields
    • Rauhut G, Pulay P. 1995. Transferable scaling factors for density functional derived vibrational force fields. J Chem Phys 9: 3093-3100.
    • (1995) J Chem Phys , vol.9 , pp. 3093-3100
    • Rauhut, G.1    Pulay, P.2
  • 15
    • 0030121844 scopus 로고    scopus 로고
    • Comparison of NMR chemical shieldings calculated from Hartree-Fock and density functional wavefunctions using gauge-including atomic orbitals
    • Rauhut G, Puyear S, Wolinski K, Pulay PJ. 1996. Comparison of NMR chemical shieldings calculated from Hartree-Fock and density functional wavefunctions using gauge-including atomic orbitals. Phys Chem 100: 6310-6316.
    • (1996) Phys Chem , vol.100 , pp. 6310-6316
    • Rauhut, G.1    Puyear, S.2    Wolinski, K.3    Pulay, P.J.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.