• 제목/요약/키워드: endo/exo

검색결과 103건 처리시간 0.026초

DFT Study of p-tert-Butylcalix[5]crown-6-ether Complexed with Alkylammonium Ions

  • Oh, Dong-Suk;Choe, Jong-In
    • Bulletin of the Korean Chemical Society
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    • 제28권4호
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    • pp.596-600
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    • 2007
  • The structures and energies of p-tert-butylcalix[5]crown-6-ether (1) and its alkylammonium complexes have been calculated by DFT B3LYP/6-31G(d,p) method. We have studied the binding sites of these host-guest complexes focusing on the p-tert-butylcalix[5]arene pocket (endo) or the crown-6-ether moiety (exo) of 1. The smaller alkylammonium cations have the better complexation efficiency with p-tert-butylcalix[5]crown-6- ether than the bulkier alkylammonium ions. For the sec- and tert-butylammonium ions, the hydrogen-bond distances of the exo-complexes are shorter, therefore, stronger than the endo-cases. This DFT calculated result is in parallel with the trend of the experimental association constants of the branched butylammonium ions.

Anti-complementary Activities of Exo- and Endo-biopolymer Produced by Submerged Mycelial Culture of Eight Different Mushrooms

  • Yang, Byung-Keun;Gu, Young-Ah;Jeong, Yong-Tae;Song, Chi-Hyun
    • Mycobiology
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    • 제35권3호
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    • pp.145-149
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    • 2007
  • The Elfvingia applanata (EA), Hericium erinaceum (HE), Grifola frondosa (GF), Pholiota nameko (PN), Pleurotus eryngii (PE), Trametes suaveolens (TS), Fomes fomentarius (FF), and Inonotus obliquus (IO) could produce the endo- (EN) and exo-biopolymer (EX) in submerged culture. The highest anti-complementary activity of the EN was exhibited by PN (49.1%), followed by HE (38.6%), TS (37.0%), and FF (33.0%), whereas the high activity of the EX was found with GF (59.8%), followed by HE (36.3%), TS (30.8%), and IO (28.8%). The EN of P. nameko (EN-PN) and EX of G. frondosa (EX-GF) were found to contain 78.6% and 41.2% carbohydrates, while 21.4% and 58.8% protein, respectively. The sugar and amino acid compositions of EN-PN and EX-GF were also analyzed in detail.

5-Methylbicyclo[2.2.1]hept-2-ene-5-carboxylates의 합성 (Synthesis of 5-methylbicyclo[2.2.1]hept-2-ene-5-carboxylates)

  • 이윤배;전준호;성언경;마동환
    • 한국산학기술학회:학술대회논문집
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    • 한국산학기술학회 2008년도 추계학술발표논문집
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    • pp.339-342
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    • 2008
  • Methacrylate와 Cyclopentadiene을 반응하여 5-methylbicyclo[2.2.1]hept-2-ene-5-carboxylate (MBHC)를 합성하고 만들어진 MBHC를 Column Chromatography를 이용하여 Endo와 Exo를 분리하였고, MBHC에 붙는 작용기에 따른 수율 및 Endo, Exo의 비율을 확인하였다.

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Cyclohexyl 5-methylbicyclo[2,2,1]hept-2-ene-5-carboxylate의 합성 (Synthesis of Cyclohexyl 5-methylbicyclo[2,2,1]hept-2-ene-5-carboxylate)

  • 이윤배;고유진;박희경
    • 한국산학기술학회:학술대회논문집
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    • 한국산학기술학회 2011년도 춘계학술논문집 1부
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    • pp.493-495
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    • 2011
  • cyclohexyl methacrylate와 cyclopentadiene을 반응하여 cyclohexyl 5-methylbicyclo[2,2,1]hept-2-ene-5-carboxylate를 합성하고 합성된 Norbornene계 화합물을 GC를 이용하여 그 비율을 측정하였고 Column Chromatography를 이용하여 endo와 exo를 분리해 $^1H-NMR$을 이용하여 endo와 exo 화합물의 구조를 확인하였다.

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Vinylsulfone Activated Agarose 에 Endo- 및 Exoinulinase의 고정화 (Immobilization of Endo- and Exoinulinase on Vinylsulfone Activated Agarose)

  • 한상배;송근섭;정용섭;손희숙;우순자;엄태봉
    • 한국미생물·생명공학회지
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    • 제20권1호
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    • pp.20-24
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    • 1992
  • Inulinase의 효율적인 재사용을 위하여 vinylsulfone activated agarose에 endo- 및 exoinulinase를 고정화시켰다. Gram gel당 exoinulinase는 400U, endoinulinase는 80U까지 고정화시킬 수가 있었고 열안정성은 exoinulinase 에서 증가되었다. 두 고정화 효소의 혼합비율에 따른 synergistic effect는 endo/exo가 0.5-0.1일 대 가장 컸으며, synergistic effect는 혼합되지 않은 상태의 고정화 효소에 비해 그 활성이 약 1.7배 증가하였다. 두 고정화 효소의 최적 pH는 4.4-5.0 범위이었으며 operational stability는 batch reactor에서 20번 반복된 실험결과 어떠한 효소활성의 감소도 보이지 않았다.

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사과겹무늬썩음병균(病菌) Botryosphaeria dothidea에 의한 Pectin질(質) 분해효소(分解酵素)의 생산 (Production of Pectolytic Enzymes by Botryosphaeria dothidea)

  • 박석희;김기홍;이창은
    • 한국균학회지
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    • 제19권2호
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    • pp.143-147
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    • 1991
  • 사과겹무늬썩음병균 Botryosphaeria dothidea를 pectin-polypectate 배지(培地)와 사과배지(培地)에 배양(培養)하여 pectin질(質) 분해효소(分解酵素)의 생산(生産)과 활성(活性)을 조사하였다. exo-polygalacturonase와 exo-polymethylgalacturonase의 활성은 사과배지에서 배양 6일에 각각 6.4 와 7.2 units로 최대의 활성을 나타내었고, 인공배지에서는 배양 8일에 각각 5.9 와 5.3 units 의 활성을 나타내었으나 사과배지에 비해 낮았다. endo-polygalactu-ronase와 endo- polymethylgalacturonase는 인공배지에서 각각 4.4 와 16.2 units로 배양 8 일과 10일에서 최대활성을 나타내었으나 사과배지에서는 배양 8일에 각각 3.2와 6.7 units로 낮은 활성을 보였다. pecti-nmethyl-trans-eliminase와 polygalacturonate-trans-eliminase의 활성은 사과배지보다 인공배지에서 높게 나타났으며, 균 생장은 인공배지와 사과배지에서 각각 배양 6일과 8일에 최고의 생장을 나타내었다.

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Endo- and Exo-Coordinated Mercury(II) Complexes of O3S2 Macrocycles: Effect of Dibenzo-Substituents on Coordination Mode

  • Lee, Ji-Eun;Kim, Hyun-Jee;Lee, So-Young;Lee, Jai-Young;Jin, Yong-Nu;Lee, Shim-Sung
    • Bulletin of the Korean Chemical Society
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    • 제28권11호
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    • pp.2041-2044
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    • 2007
  • The reactions of mercury(II) chloride with O3S2-donor macrocyclic ligands with (L1) and without (L2) dibenzosubunit afforded respective exo- (1) and endo-coordinated (2) complexes depending on the ring rigidity of the ligands. From the X-ray crystal structures and comparative NMR studies for the complexes 1 and 2, it is confirmed that the resulting species with different coordination modes exist not only in solid state but also in solution state.

Hypolipidemic Effect of Exo- and Endo-Biopolymers Pmduced from Submerged Mycelial Culture of Ganoderma lucidum in Rats

  • Yang, Byung-Keun;Jeong, Sang-Chul;Song, Chi-Hyun
    • Journal of Microbiology and Biotechnology
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    • 제12권6호
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    • pp.872-877
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    • 2002
  • The hypolipidemic effect of the exe-biopolymer (EXBP) and endo-biopolymer (ENBP) produced from a submerged mycelial culture of Ganoderma lucidum was investigated in dietary-induced hyperlipidemic rats. Hypolipidemic effects were achieved in both the EXBP- and ENBP-treated groups, however, the former proved to be more potent than the latter. The administration of the EXBP (100 mg/kg body weight) substantially reduced the plasma total cholesterol, low-density lipoprotein (LDL) cholesterol, triglyceride, phospholipid levels, and atherogenic index by 31.0, 39.0, 35.4, 28.1, and 53.5%, respectively, when compared to the control group. The EXBP also lowered the liver total cholesterol, triglyceride, and phospholipid levels by 22.4, 23.1, and 12.9%, respectively. Furthermore, the high-density lipoprotein (HDL) cholesterol and ratio of HDL cholesterol to total cholesterol were significantly increased by as much as 24.2% and 47.6%, respectively.

Diels-Alder 반응을 이용한 methyl 5-methylbicyclo(2-2.1)hept-2-ene-5-carboxylate의 합성 (Synthesis of methyl 5-methylbicyclo (2.2-1)hept-2-ene-5- carboxylate via Diels-Alder Reaction)

  • 이윤배;성시창;신은정;하홍식;박찬흥
    • 한국산학기술학회:학술대회논문집
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    • 한국산학기술학회 2004년도 추계학술대회
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    • pp.265-268
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    • 2004
  • Methyl methacrlate와 cyclopentadiene을 반응하여 Methyl 5-methylbicyclo(2.2.1)hept-2-ene-5-carboxylate(MMBHC)를 합성코자 하였다. 합성된 MMBHC의 온도, solvent 변화와 촉매($AlCl_3$)의 사용 유무에 따른 endo, exe의 비율을 관찰하였다. 온도가 낮은 경우 온도가 높은 쪽 보다 endo 비율이 높았고 촉매($AlCl_3$)를 사용하였을 때(약 endo : exo = 63 : 37) 촉매를 사용하지 않은 반응(endo : exe = 34 : 66)보다 endo의 비율이 높았다. methyl acrylate를 사용한 경우 같은 조건에서 endo : exe의 비율이 93.5 : 6.5로 MMA를 사용한 경우보다 endo의 비율은 좋았다. 온도가 높은 경우 수율은 좋았지만 exe의 비율이 높았고 solvent에 따라 endo, exe의 선택도는 큰 차이를 보이지 않음을 알 수 있었다.

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mPW1PW91 Study of Complexation of Alkali Metal Ions with Mixed [2 + 2'] Calix[4]aryl Derivatives

  • Choe, Jong-In
    • Bulletin of the Korean Chemical Society
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    • 제33권10호
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    • pp.3321-3330
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    • 2012
  • The complexation characteristics of mixed [2 + 2'] calix[4]aryl derivatives (3 and 4) with alkali metal cations were investigated by the mPW1PW91 (hybrid HF-DF) calculation method. The total electronic and Gibbs free energies of the various complexes (cone, partial-cone, 1,2-alternate, and 1,3-alternate) of sodium and potassium cations with 3 and 4 were analyzed and compared. The structures of the endo- or exo-complexes of the alkali metal cation with the host 3 were optimized using the mPW1PW91/6-31G(d) method, followed by mPW1PW91/6-311+G(d) calculations. The structures of the endo- or exo-complexes of the alkali metal cation with the host 4 were optimized using the mPW1PW91/6-31G(d,p) method. The mPW1PW91 calculated relative energies of the various conformations of the free hosts (3 and 4) suggest that the cone conformers of 3 and 4 are the most stable. The mPW1PW91calculations also suggest that the complexation efficiencies of the sodium ion with hosts 3 and 4 are about 24 and 27 kcal/mol better than those of the potassium ion, respectively. These trends are in good agreement with the experimental results. The exo-complexation efficiencies of the sodium ion toward the conformers of hosts 3 and 4 are roughly 14 and 17 kcal/mol better than those for the endo-$Na^+$-complexes of 3 and 4, respectively. The exo-complexation of the cone isomer of 3 with cation could be confirmed by the differences of the diagnostic C=O bands in the free host and its complex's IR spectra.