• Bulletin of the Korean Chemical Society
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• 제14권2호
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• pp.200-206
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• 1993

Structures of two polymorphs of ${\alpha},{\alpha}$-trehalose octaacetate monohydrate, $C_{28}H_{38}O_{19}\;{\cdot}\;H_2O$, have been studied by X-ray diffraction method. ${\alpha},{\alpha}$-trehalose (${\alpha}$-D-glucopyranosyl ${\alpha}$-D-glucopyranoside) is a nonreducing disaccharide. The polymorph I belongs to the monoclinic $P2_1$, and has unit cell parameters of a=10.725(l), b=15.110(4), c=11.199(5) ${\AA}$, ${\beta}=108.16(2)^{\circ}$ and Z=2. The polymorph II is orthorhombic $P2_12_12_1$, with a=13.684(4), b=15.802(4), c=17.990(9) ${\AA}$ and Z=4. The final R and R$_w$ values for monoclinic polymorph I are 0.043 and 0.048 and for orthorhombic polymorph II are 0.116 and 0.118, respectively. Those R values of polymorph II are high because the large thermal motions of acetyl groups and the poor quality of the crystal. The molecular conformations in the two polymorphs are similar. Both D-glucopyranosyl rings have chair $^4C_1$ conformations and atoms of glycosidic chain ${\alpha}(1{\rightarrow}1)$ linkage are coplanar. The primary acetate groups of the pyranose residues assume both gauche-trans conformations. The molecules of two polymorphs have pseudo-C$_2$ symmetry at glycosidic O(1) atom. The bond lengths and angles are normal compared with those in other acetylated sugar compounds. The molecules in the monoclinic crystal are held by the hydrogen bonds with the water molecules and by van der Waals forces.

• Bulletin of the Korean Chemical Society
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• 제6권4호
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• pp.202-206
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• 1985

The crystal structure of The crystal structure of $Ag^+$-Exchanged Zeolite A, $Ag_{4.6}Na_{7.4}-A$, dehydrated, treated with $H_2$, and evacuated, all at $350^{\circ}C$, has been determined by single crystal x-ray diffraction methods in the cubic space group Pm3m at $24(1)^{\circ}C;$ a = $12.208(2)\AA.$ The structure was refined to the final error indices R1 = 0.088 and R2 (weighted) = 0.069 using 194 independent reflections for which II_0$ > $3{\sigma}(I_0)$. On threefold axes near the centers of 6-oxygen rings, $7.4 Na^+$ ions and $0.6 Ag^+$ ions are found. Two non-equivalent 8-ring $Ag^+$ ions are found off the 8-ring planes, each containing about $0.6 Ag^+$ ions. Three non-equivalent Ag atom positions are found in the large cavity, each containing about 0.6 Ag atoms. This crystallographic analysis may be interpreted to indicate that $0.6 (Ag_6)^{3+}$ clusters are present in each large cavity. This cluster may be viewed as a nearly linear trisilver molecule $(Ag_3)^0$ (bond lengths, 2.92 and 2.94 $\AA;$ angle, $153^{\circ})$ stabilized by the coordination of each atom to a Ag^+$ ion at 3.30, 3.33, and 3.43 $\AA$, respectively. In addition, one of the silver atoms approaches all of the 0(1) oxygens of a 4-ring at $2.76\AA.$ Altogether $7.4 Na^+$ ions, $1.8 Ag^+$ ions, and 1.8 Ag atoms are located per unit cell. The remaining $1.0 Ag^+$ ion has been reduced and has migrated out of the zeolite framework to form silver crystallites on the surface of the zeolite single crystal.

• Bulletin of the Korean Chemical Society
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• 제10권3호
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• pp.234-238
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• 1989

The crystal structure of partially $Ag^+$-exchanged zeolite A, $Ag_{3.2}Na_{8.8}$-A, vacuum dehydrated at $360^{\circ}C$ and then exposed to 0.1 torr of cesium vapor for 12 hours at $250^{\circ}C$ has been determined by single-crystal X-ray diffraction techniques in the cubic space group Pm3m (a = 12.262(2)${\AA})\;at\;21(1)^{\circ}C$. The structure was refined to the final error indexes $R_1=0.068\;and\;R_2=0.072$ by using 338 reflections for which $I_o\;>\;3{\sigma}(I_o)$ and the composition of unit cell is $Ag_{3.2}Cs_{8.8}-A.\;3\;Cs^+$ ions lie on the centers of the 8-rings at sites of D4h symmetry. Two crystallographycally different 6-ring $Cs^+$ ions were found: 1.5 $Cs^+$ ions at Cs(2) are located inside of sodalite cavity and 4.3 $Cs^+$ ions at Cs(3) are located in the large cavity. The fractional occupancies observed at Cs(2) and Cs(3) indicate that the existence of at least three types of unit cells with regard to the 6-ring $Cs^+$ ions. For example, 50% of unit cells may have two $Cs^+$ ions at Cs(2) and 4 $Cs^+$ ions at Cs(3). 30% of unit cells may have one Cs+ ion at Cs(2) and 5 $Cs^+$ ions at Cs(3). The remaining 20% would have one $Cs^+$ ion at Cs(2) and 4 $Cs^+$ ions at Cs(3). On threefold axes of the unit cell two non-equivalent Ag atom positions are found in the large cavity, each containing 0.64 and 1.92 Ag atoms, respectively. A crystallographic analysis may be interpreted to indicate that 0.64 $(Ag_5)^+$ clusters are present in each large cavity. This cluster may be viewed as a tetrasilver molecule $(Ag_4)^0$(bond length, 2.84${\AA}$) stabilized by the coordination of one $Ag^+$ ion.

• 멤브레인
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• 제31권3호
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• pp.184-199
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• 2021

공유결합 유기 구조체(COF)의 한 가지로서, 공유결합 트리아진 구조체(CTF)는 이온 열 삼량 체화 반응을 통해 제조된 반복되는 육각형 트리아진 고리의 네트워크로 구성되어 본질적으로 다공성 구조를 가진다. 또한 일부 화학 물질에 대한 친화성을 높이고 다른 화학 물질을 배제하는 많은 질소 작용기를 포함한다. 조절 가능한 특성 때문에 많은 연구자들이 기체 및 액체 분리 공정을 위한 CTF의 소재를 합성하고 테스트했다. 새로운 CTF, 혼합 CTF 복합재 및 CTF 멤브레인에 대한 다양한 연구가 기체흡착, 기체분리(예 : CO₂, C₂H₂, H₂ 등) 및 담수화에 대해 연구되었다. 일부 CTF 연구는 고급 컴퓨터 시뮬레이션을 통해 한계와 잠재력을 결정했으며 후속 실험에서는 광촉매 특성에 대한 CTF를 테스트하여 더 큰 지속 가능성을 위한 재활용 가능성을 제안했다. 이 총설에서는 공유결합 트리아진 구조체 기반 분리막에 대해 설명할 예정이다.

• Journal of the Korean Wood Science and Technology
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• 제30권2호
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• pp.79-86
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• 2002

물푸레나무속의 물푸레나무, 들메나무 및 쇠물푸레의 해부학적 특성을 광학현미경법과 화상분석법에 의해 조사하였다. 공시 수종간에 연륜 경계의 명확성을 비롯한 도돤 요소의 직경, 축방향유조직의 배열상태, 구성세포의 비율에서 차이가 있었다. 구성요소의 방사방향 변이에 있어서, 목섬유 길이, 도관 요소 직경 및 길이는 수심 부위에서 작고 약 10~15 연륜까지 증가한 후 안정되었다. 결론적으로 본 연구 결과는 물푸레나무속 세 수종의 식별자료 및 성숙재와 미성숙재를 구분하는 재질 지표치로 이용될 수 있을 것으로 생각된다.

• 한국미생물·생명공학회지
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• 제49권2호
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• pp.174-180
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• 2021

Chalcones exhibit multiple biological activities. Various studies have attempted to modify the structure of chalcones with a special focus on the addition of substituents to the benzene rings. However, these chemical modifications did not improve the water solubility and bioavailability of chalcones. Glycosylation can markedly affect the physical and chemical properties of hydrophobic compounds. Here, we evaluated the ability of a highly promiscuous glycosyltransferase (GT) BsGT1 from Bacillus subtilis ATCC 6633 to biosynthesize chalcone glucosides. Purified BsGT1 catalyzed the conversion of 4'-hydroxychalcone (compound 1), 4'-hydroxy-4-methylchalcone (compound 2), and 4-hydroxy-4'-methoxychalcone (compound 3), into chalcone 4'-O-β-D-glucoside (compound 1a), 4-methylchalcone 4'-O-β-D-glucoside (compound 2a), and 4'-methoxychalcone 4-O-β-D-glucoside (compound 3a), respectively. To avoid the addition of expensive uridine diphosphate glucose (UDP-Glc), a whole-cell biotransformation system was employed to provide a natural intracellular environment for in situ co-factor regeneration. The yields of compounds 1a, 2a, and 3a were as high as 90.38%, 100% and 74.79%, respectively. The successful co-expression of BsGT1 with phosphoglucomutase (PGM) and UDP-Glc pyrophosphorylase (GalU), which are involved in the biosynthetic pathway of UDP-Glc, further improved the conversion rates of chalcones (the yields of compounds 1a and 3a increased by approximately 10%). In conclusion, we demonstrated an effective whole-cell biocatalytic system for the enzymatic biosynthesis of chalcone β-D-glucoside derivatives.

• The Korean Journal of Physiology and Pharmacology
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• 제26권4호
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• pp.255-262
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• 2022

Oxytocin is a neuropeptide produced primarily in the hypothalamus and plays an important role in the regulation of mammalian birth and lactation. It has been shown that oxytocin has important cardiovascular protective effects. Here we investigated the effects of oxytocin on vascular reactivity and underlying the mechanisms in human umbilical vein endothelial cells (HUVECs) in vitro and in rat aorta ex vivo. Oxytocin increased phospho-eNOS (Ser 1177) and phospho-Akt (Ser 473) expression in HUVECs in vitro and the aorta of rat ex vivo. Wortmannin, a specific inhibitor of phosphatidylinositol 3-kinase (PI3K), inhibited oxytocin-induced Akt and eNOS phosphorylation. In the rat aortic rings, oxytocin induced a biphasic vascular reactivity: oxytocin at low dose (10^-9-10^-8 M) initiated a vasorelaxation followed by a vasoconstriction at high dose (10^-7 M). L-NAME (a nitric oxide synthase inhibitor), endothelium removal or wortmannin abolished oxytocin-induced vasorelaxation, and slightly enhanced oxytocin-induced vasoconstriction. Atosiban, an oxytocin/vasopressin 1a receptor inhibitor, totally blocked oxytocin-induced relaxation and vasoconstriction. PD98059 (ERK1/2 inhibitor) partially inhibited oxytocin-induced vasoconstriction. Oxytocin also increased aortic phospho-ERK1/2 expression, which was reduced by either atosiban or PD98059, suggesting that oxytocin-induced vasoconstriction was partially mediated by oxytocin/V1aR activation of ERK1/2. The present study demonstrates that oxytocin can activate different signaling pathways to cause vasorelaxation or vasoconstriction. Oxytocin stimulation of PI3K/eNOS-derived nitric oxide may participate in maintenance of cardiovascular homeostasis, and different vascular reactivities to low or high dose of oxytocin suggest that oxytocin may have different regulatory effects on vascular tone under physiological or pathophysiological conditions.

• 한국인터넷방송통신학회논문지
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• 제23권1호
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• pp.177-182
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• 2023

교통약자의 이동성 증진에 관한 법률은 교통약자가 대중교통을 이용할 때 편의를 누릴 수 있어야 한다고 규정하고 있다. 하지만 "시각장애인이 버스를 탈 수 있도록 해달라"는 청원을 제기할 정도로 이 법이 제대로 시행되지 않고 있다. 대중교통 대신 장애인 콜택시를 이용하려 해도 신청하고 2~3시간 기다려야 한다. 따라서 본 논문은 블루투스를 이용하여 지정된 버스와 지하철역에서 지팡이가 알림음을 울릴 경우 개찰구의 개방시간을 평소보다 늘리는 등 취약계층과 보호자를 위한 시스템을 설계하고 구현하는 것을 목표로 한다. 이에 따라 취약계층의 대중교통 이용 가능성과 경제적 저축, 안전보장, 실종아동 예방 등의 효과가 있을 것으로 기대된다.

• 대한본초학회지
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• 제33권5호
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• pp.19-37
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• 2018

Objectives : Oryeong-san was composed of Alismatis Rhizoma, Atractylodis Rhizoma Alba, Poria Sclerotium, Polyporus, Cinnamomi Cortex, and known to have hundreds of chemical compounds. The aim of this study was to screen chemical compounds constituting Oryeong-san with the drug-likeness and oral bioavailability from the analysis of their physicochemical properties. Methods : A list of chemical compounds of Oryeong-san was obtained from TM-MC(database of medicinal materials and chemical compounds in Northeast Asian traditional medicine). To remove redundant compounds, the SMILES (Simplified Molecular Input Line Entry System) strings of each compound were identified. All of the physicochemical properties for the compounds were calculated using the DruLiTo(Drug Likeness Tool). Drug-likeness was estimated by QED(Quantitative Estimate of Druglikeness) and OB(Oral bioavailability) was checked based on the Veber's rules. Results : A total of 475 compounds were obtained by eliminating duplication among 544 compounds of 5 medicinal materials. Analysis of the physicochemical properties revealed that the most common values were MW(molecular weight) 200~300 g/mol, ALOGP(octanol-water partition coefficient) 1~2, HBA(number of hydrogen bond acceptors) 0~1, HBD(number of hydrogen bond donors) 0, PSA(polar surface area) 0~50 angstrom, ROTB(number of rotatable bonds) 1, AROM(number of aromatic rings) 0, and ALERT(number of structural alerts) 1. QED had 93% of the values between 0.2 and 0.7, and OB had 90% of the value of TRUE. Conclusions : We in this paper screened the candidate active compounds of Oryeong-san using the QED and Veber's rules. In the future, we will use the screening results to analyze the mechanism of Oryeong-san based on systems pharmacology.

• 대한수학회지
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• 제59권3호
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• pp.571-594
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• 2022

Let D be an integral domain with quotient field K, Pic(D) be the ideal class group of D, and X be an indeterminate. A polynomial overring of D means a subring of K[X] containing D[X]. In this paper, we study almost Dedekind domains which are polynomial overrings of a principal ideal domain D, defined by the intersection of K[X] and rank-one discrete valuation rings with quotient field K(X), and their ideal class groups. Next, let ℤ be the ring of integers, ℚ be the field of rational numbers, and 𝔊f be the set of finitely generated abelian groups (up to isomorphism). As an application, among other things, we show that there exists an overring R of ℤ[X] such that (i) R is a Bezout domain, (ii) R∩ℚ[X] is an almost Dedekind domain, (iii) Pic(R∩ℚ[X]) = $\oplus_{G{\in}G_{f}}$ G, (iv) for each G ∈ 𝔊f, there is a multiplicative subset S of ℤ such that RS ∩ ℚ[X] is a Dedekind domain with Pic(RS ∩ ℚ[X]) = G, and (v) every invertible integral ideal I of R ∩ ℚ[X] can be written uniquely as I = XnQe11···Qekk for some integer n ≥ 0, maximal ideals Qi of R∩ℚ[X], and integers ei ≠ 0. We also completely characterize the almost Dedekind polynomial overrings of ℤ containing Int(ℤ).