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Application of an Organophosphorus Compound-DEPBT as Coupling Reagent in Liquid Phase Peptide Synthesis
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作者 Yan Nei HE Yao LIN(Department of Chemistry. Beijing University. Beijing 100871) 《Chinese Chemical Letters》 SCIE CAS CSCD 1997年第9期749-750,共2页
DEPBT, a novel coupling reagent containing phosphorus, was used in synthesis of pentapeptide Boc-Ile-Asn-Met-Trp(For)-Gly.OMe by solution method.
关键词 Application of an Organophosphorus Compound-DEPBT as coupling Reagent in liquid Phase Peptide Synthesis MET
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Hyperbolic Plasmons in Coupled Luttinger Liquids of Homochiral Carbon Nanotube Arrays
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作者 Saiqun Ma Jiajun Chen +17 位作者 Cheng Hu Kunqi Xu Yufeng Xie Xingdong Luo Zhenghan Wu Yi Chen Xianliang Zhou Shuo Lou Bosai Lyu Peiyue Shen Zhichun Zhang Aolin Deng Chengjia Zhang Qi Liang Ming Tian Neng Wan Ji-Hun Kang Zhiwen Shi 《Chinese Physics Letters》 2025年第9期224-245,共22页
A Luttinger liquid is a theoretical model describing interacting electrons in one-dimensional(1D)conductors.While individual 1D conductors have shown interesting Luttinger-liquid behaviors such as spin-charge separati... A Luttinger liquid is a theoretical model describing interacting electrons in one-dimensional(1D)conductors.While individual 1D conductors have shown interesting Luttinger-liquid behaviors such as spin-charge separation and power-law spectral density,the more interesting phenomena predicted in coupled Luttinger liquids of neighboring 1D conductors have been rarely observed due to the difficulty in creating such structures.Recently,we have successfully grown close-packed carbon nanotube(CNT)arrays with uniform chirality,providing an ideal material system for studying the coupled Luttinger liquids.Here,we report on the observation of tunable hyperbolic plasmons in the coupled Luttinger liquids of CNT arrays using scanning near-field optical microscopy.These hyperbolic plasmons,resulting from the conductivity anisotropy in the CNT array,exhibit strong spatial confinement,in situ tunability,and a wide spectral range.Despite their hyperbolic wavefronts,the plasmon propagation in the axial direction still adheres to the Luttinger-liquid theory.Our work not only demonstrates a fascinating phenomenon in coupled Luttinger liquids for fundamental physics exploration,but also provides a highly confined and in situ tunable hyperbolic plasmon in close-packed CNT arrays for future nanophotonic devices and circuits. 展开更多
关键词 interacting electrons carbon nanotube arrays hyperbolic plasmons luttinger liquid scanning near field optical microscopy d conductors carbon nanotube cnt arrays coupled Luttinger liquids
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Separation and identification of moxifloxacin impurities in drug substance by high-performance liquid chromatography coupled with ultraviolet detection and Fourier transform ion cyclotron resonance mass spectrometry 被引量:8
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作者 Cai Sheng Wu Zhi Xin Jia +2 位作者 Bao Ming Ning Jin Lan Zhang Song Wu 《Chinese Chemical Letters》 SCIE CAS CSCD 2012年第10期1185-1188,共4页
In this paper, a high-performance liquid chromatography coupled with ultraviolet detection and Fourier transform-ion cyclotron resonance mass spectrometry (HPLC-UV/FrICRMS) method was described for the investigation... In this paper, a high-performance liquid chromatography coupled with ultraviolet detection and Fourier transform-ion cyclotron resonance mass spectrometry (HPLC-UV/FrICRMS) method was described for the investigation of impurity profile in moxifloxacin (MOX) drug substance and chemical reference substance. Ten impurities were detected by HPLC-UV, while eight impurities were identified by using the high accurate molecular mass combined with multiple-stage mass spectrometric data and fragmentation rules. In addition, to our knowledge, five impurities were founded for the first time in MOX drug substance. 展开更多
关键词 Moxifloxacin (MOX) Impurity profile High-performance liquid chromatography coupled with ultraviolet detection and Fouriertransform-ion cyclotron resonance mass spectrometry (HPLC-UV/bTICRMS)
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Effect of pediatric tuina on hypothalamic metabolites in young rabbits using liquid chromatography-mass spectrometry 被引量:1
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作者 Zhifeng Liu Yi Jiao +7 位作者 Tianyuan Yu Yingqi Zhang Di Liu Hourong Wang Yajing Xu Qian Guan Taotao Lv Jian Shu 《Journal of Traditional Chinese Medical Sciences》 2022年第2期188-196,共9页
Objective: To investigate the changes in the hypothalamic metabolites of lipopolysaccharide(LPS) febrile young rabbits after the treatment with pediatric tuina.Methods: A total of 30 young rabbits were randomly assign... Objective: To investigate the changes in the hypothalamic metabolites of lipopolysaccharide(LPS) febrile young rabbits after the treatment with pediatric tuina.Methods: A total of 30 young rabbits were randomly assigned into three groups: the normal group, the model group, and the tuina group. Both the model group and the tuina group were injected intravenously with LPS. “Six antipyretic manipulations”(pushing Tianmen, pushing Kangong, kneading Taiyang,kneading Erhougaogu, clearing Tianheshui, and pushing Jizhu) were administered 1 h after the LPS injection in the tuina group. The rectal temperatures of the young rabbits were monitored during the experiment to explore the antipyretic effect. Three hours after the injection, the content of interleukin-1β(IL-1β), tumor necrosis factor(TNF)-a, and prostaglandin E;(PGE;) in the serum was detected. In addition, liquid chromatography-mass spectrometry(LC-MS) was used for the hypothalamus metabolomics.Results: Compared with the model group, the rectal temperature of the tuina group was decreased at 2 h and 3 h after the LPS injection(P =.04, P =.03, respectively), and the content of IL-1β, TNF-a, and PGE2was decreased(P =.03, P =.003, and P =.008, respectively). The metabolomics results showed that there were 23 potential biomarkers after the tuina intervention, enriching 27 pathways. Lipid metabolites,especially glycerophospholipids, were a majority of the altered metabolites. The primary metabolic pathways affected by tuina included the arachidonic acid metabolism, the GABAergic synapse, D-glutamine and D-glutamate metabolism, and the glutamatergic synapse.Conclusion: Pediatric tuina reduced the temperature of the febrile rabbits and downregulated the expression of IL-1β, TNF-a, and PGE2, and the antipyretic mechanism may be related to changes in metabolites and metabolic pathways in the hypothalamus. 展开更多
关键词 FEVER Pediatric tuina Metabolomics liquid chromatography coupled with mass spectrometry HYPOTHALAMUS INTERLEUKIN-1B Tumor necrosis factor-a Prostaglandin E_(2)
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Rapid Screening of 26 Organophosphorus Pesticides in Fresh Milk by Ultra Liquid Chromatography Coupled With Quadrupole-Time of Flight Mass Spectrometry 被引量:1
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作者 Yi LI Luman HUO +4 位作者 Lei WANG Lixue DONG Aijun LI Yi ZHANG Baiqin ZHENG 《Agricultural Biotechnology》 CAS 2021年第5期131-133,共3页
[Objectives]A rapid screening and analysis method for 26 organophosphorus agrochemicals in fresh milk was established using ultra performance liquid chromatography coupled with quadrupole-time of flight mass spectrome... [Objectives]A rapid screening and analysis method for 26 organophosphorus agrochemicals in fresh milk was established using ultra performance liquid chromatography coupled with quadrupole-time of flight mass spectrometry.[Methods]Raw milk was extracted with acetonitrile solution containing 0.2%formic acid by volume,and purified with a Dikma ProElut QuECHERS solid phase extraction cartridge.Target compounds were separated on a Waters ACQUITY UPLC HSS T3 chromatographic column(2.1 mm×50 mm,1.8μm)with methanol-water solution as a mobile phase for gradient elution,and through scanning with an electrospray ion source in positive ion mode,26 kinds of organophosphorus agrochemicals could be accurately qualitatively determined within 10 min.[Results]When using formic acid acetonitrile with a volume fraction of 0.2%,there were more types of detected compounds and a greater recovery;and using B cartridge could effectively eliminate the interference of non-polar substances such as phospholipids,achieve higher number of detected compounds than those of A and C,and well separate the 26 kinds of agrochemical residues.[Conclusions]This study provides a reference method for the rapid screening of agrochemical residues in dairy cows in the future. 展开更多
关键词 Ultra liquid chromatography coupled with quadrupole-time of flight mass spectrometry(UPLC-Q-TOF-MS) Fresh milk Organophosphorus agrochemicals Rapid screening
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Lysophosphatidylcholine Biomarkers of Lung Cancer Detected by Ultra-performance Liquid Chromatography Coupled with Quadrupole Time-of-flight Mass Spectrometry
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作者 DONG Jun CAI Xiao-ming +4 位作者 ZOU Li-juan CHEN Cheng XUE Xing-ya ZHANG Xiu-li LIANG Xin-miao 《Chemical Research in Chinese Universities》 SCIE CAS CSCD 2011年第5期750-755,共6页
Centrifugal ultrafiltration after methanol extraction of whole plasma was used as an optimal condition for the preparation of blood plasma before metabonomic studies. The plasma samples from 102 lung cancer patients a... Centrifugal ultrafiltration after methanol extraction of whole plasma was used as an optimal condition for the preparation of blood plasma before metabonomic studies. The plasma samples from 102 lung cancer patients and 34 healthy volunteers were prepared with this approach. With ultra-performance liquid chromatography(UPLC) coupled with quadrupole time-of-flight mass spectrometry(Q-TOF MS) analysis, the samples were investigated in order to find potential disease biomarkers. After data acquisition, orthogonal signal correction partial least squares models were built to differentiate the healthy volunteers from lung cancer patients and to identify metabolites that showed significantly different expression between the two groups. Several metabolite ions were identified as potential biomarkers according to the variable importance in the project(VIP) value in both ion modes. Five lysophosphatidylcholines were further identified as specifically lysoPC 16:0, isomer of lysoPC 16:0, lysoPC 18:0, lysoPC 18:1 and lysoPC 18:2. These results suggest that UPLC coupled with Q-TOF MS is an effective technique for the analysis of plasma metabolites in metabonomic studies. 展开更多
关键词 METABONOMICS Sample preparation Ultra-performance liquid chromatography coupled with quadrupoletime-of-flight mass spectrometry(UPLC/Q-TOF MS) Lung cancer Biomarker
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Analysis of Low-polar Ginsenosides in Steamed Panax Ginseng at High-temperature by HPLC-ESI-MS/MS 被引量:9
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作者 ZHANG Yu-chi1,2, PI Zi-feng1, LIU Chun-ming2, SONG Feng-rui1, LIU Zhi-qiang1 and LIU Shu-ying1 1. Changchun Center of Mass Spectrometry, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022, P. R. China 2. Central Laboratory, Changchun Normal University, Changchun 130032, P. R. China 《Chemical Research in Chinese Universities》 SCIE CAS CSCD 2012年第1期31-36,共6页
A high performance liquid chromatography coupled with electrospray ionization-tandem mass spectrome try(HPLC-ESI-MS/MS) method was developed for the analysis and identification of ginsenosides in the extracts of raw... A high performance liquid chromatography coupled with electrospray ionization-tandem mass spectrome try(HPLC-ESI-MS/MS) method was developed for the analysis and identification of ginsenosides in the extracts of raw Panax ginseng(RPG) and steamed Panax ginseng at high temperatures(SPGHT). A total of 25 ginsenosides were extracted include of which 10 low-polar ginsenosides, such as ginsenosides F4, Rk3, Rh4, 20S-Rg3, 20R-Rg3 and so on, were identified according to their HPLC retention time and MS/MS data. The results indicated that the low polar ginsenosides were seldom found in RPG. For the exploration of the transformation pattern of the ginsenosides in steam processing, the standards of ginsenosides Re, Rg1, Rb1, Rc, Rb2, Rb3 and Rd were selected and hydrolyzed at a temperature of 120 oC. The results show that these polar ginsenosides can be converted to low-polar ginsenosides such as Rg2, Rg6, F4, Rk3 and Rg5 by hydrolyzing the sugar chains. 展开更多
关键词 GINSENOSIDE HYDROLYSIS Steamed Panax ginseng High performance liquid chromatography coupled withelectrospray ionization-tandem mass spectrometry(HPLC-ESI-MS/MS)
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Urinary metabolomics analysis of the anti-depressive effects of Hemerocallis citrina extracts in a simulated microgravity-induced rat model of depression 被引量:6
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作者 Teng Xu Yan Wang +7 位作者 Cong Lu Li Feng Linxi Fan Jing Sun Bei Fan Qiong Wang Xinmin Liu Fengzhong Wang 《Journal of Chinese Pharmaceutical Sciences》 CAS CSCD 2020年第3期176-191,共16页
We investigated the antidepressant-like activity of Hemerocallis citrine Baroni extract(HCE)in a simulated microgravity(SMG)-induced rat model of depression using a metabolomics method.A rat model,generated via 14 d o... We investigated the antidepressant-like activity of Hemerocallis citrine Baroni extract(HCE)in a simulated microgravity(SMG)-induced rat model of depression using a metabolomics method.A rat model,generated via 14 d of SMG induction,was validated from the reduced sucrose preference and the enhanced immobility time in the forced swimming test.HCE and paroxetine reversed certain metabolite profiles.Anti-depressant effects of HCE might involve the regulation of several metabolic pathways,such as phenylalanine,glutamic acid,and tryptophan metabolism and changes in energy metabolism.5-Hydroxytryptophan,hippuric acid,phenylacetylglycine,citric acid,3-hydroxykynurenine,cyclic AMP,and L-DOPA profiles were altered upon HCE and paroxetine administration.Furthermore,glutamic acid was only regulated in the HCE group,while xanthurenic acid and deoxyuridine were reversed in the positive group,suggesting differences in the mechanisms between the positive drugs and HCE in improving glutamic acid metabolism.This study provided a theoretical foundation for the application of HCE in depression therapy. 展开更多
关键词 Hemerocallis citrina Anti-depressive Ultra-performance liquid chromatography quadrupole time-of-flight mass spectrometry Ultra-high performance liquid chromatography coupled to triple-quadrupole mass spectrometry Metabolomics
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liver and the defects of cholesterol and bile acids biosynthesis: rare disorders many diagnostic pitfalls 被引量:2
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作者 Gaetano Corso Antonio Dello Russo Monica Gelzo 《World Journal of Gastroenterology》 SCIE CAS 2017年第29期5257-5265,共9页
In recent decades, biotechnology produced a growth of knowledge on the causes and mechanisms of metabolic diseases that have formed the basis for their study, diagnosis and treatment. Unfortunately, it is well known t... In recent decades, biotechnology produced a growth of knowledge on the causes and mechanisms of metabolic diseases that have formed the basis for their study, diagnosis and treatment. Unfortunately, it is well known that the clinical features of metabolic diseases can manifest themselves with very different characteristics and escape early detection. Also, it is well known that the prognosis of many metabolic diseases is excellent if diagnosed and treated early. In this editorial we briefly summarized two groups of inherited metabolic diseases, the defects of cholesterol biosynthesis and those of bile acids. Both groups show variable clinical manifestations but some clinical signs and symptoms are common in both the defects of cholesterol and bile acids. The differential diagnosis can be made analyzing sterol profiles in blood and/or bile acids in blood and urine by chromatographic techniques(GC-MS and LC-MS/MS). Several defects of both biosynthetic pathways are treatable so early diagnosis is crucial. Unfortunately their diagnosis is made too late, due either to the clinical heterogeneity of the syndromes(severe, mild and very mild) that to the scarcity of scientific dissemination of these rare diseases. Therefore, the delay in diagnosis leads the patient to the medical observation when the disease has produced irreversible damages to the body. Here, we highlighted simple clinical and laboratory descriptions that can potentially make you to suspect a defect in cholesterol biosynthesis and/or bile acids, as well, we suggest appropriate request of the laboratory tests that along with common clinical features can help to diagnose these defects. 展开更多
关键词 CHOLESTEROL Bile acids Liver metabolism Gas chromatography coupled to mass spectrometry liquid chromatography coupled to tandem mass spectrometry
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Identification and determination of the major constituents in traditional Chinese medicine Longdan Xiegan Pill by HPLC-DAD-ESI-MS 被引量:5
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作者 Hui Liu Juan Su +5 位作者 Xu Liang Xi Zhang Ya-Jun He Hai-Qiang Huan Ji Ye Wei-Dong Zhang 《Journal of Pharmaceutical Analysis》 SCIE CAS 2011年第1期1-7,共7页
A novel and sensitive HPLC-UV method has been developed for the simultaneous determination of twelve major compounds in Longdan Xiegan Pill.The chemical profile of the twelve compounds,including geniposidic acid(1),... A novel and sensitive HPLC-UV method has been developed for the simultaneous determination of twelve major compounds in Longdan Xiegan Pill.The chemical profile of the twelve compounds,including geniposidic acid(1),geniposide(2),gentiopicroside(3),liquiritin(4),crocin(5),baicalin(6),wogonoside(7),baicalein(8),glycyrrhizic acid(9),wogonin(10),oroxylin A(11)and aristolochic acid A(12),was acquired using high-performance liquid chromatography-diode array detector coupled with an electrospray tandem mass spectrometer(HPLC-DAD-ESI-MS).The analysis was performed on a Dikma Platisil ODS C18 column(250 mm×4.6 mm,5 μm)with a gradient solvent system of acetonitrile-0.1% aqueous formic acid.The validation was carried out and the linearities(r〉0.9996),repeatability(RSD〈1.8%),intra-and inter-day precision(RSD〈1.3%),and recoveries(ranging from 96.6% to 103.4%)were acceptable.The limits of detection(LOD)of these compounds ranged from 0.29 to 4.17 ng.Aristolochic acid A,which is the toxic ingredient,was not detected in all the batches of Longdan Xiegan Pill.Furthermore,hierarchical cluster analysis was used to evaluate the variation of the herbal prescription.The proposed method is simple,effective and suitable for the quality control of this traditional Chinese medicine(TCM). 展开更多
关键词 Longdan Xiegan Pill high-performance liquid chromatography-diode array detector coupled with an electrospray tandem mass spectrometer(HPLC-DAD-ESI-MS) qualitative evaluation aristolochic acid A hierarchical cluster analysis
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Studies of the intestinal absorption of the alkaloids in the Wu-tou decoction combined with different incompatible medicinal herbs in a Caco-2 cell culture system using UPLC-MS/MS 被引量:5
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作者 Hong Kan Wen-Yue Jiang +3 位作者 Ru Ding Zhong-Ying Liu Zi-Feng Pi Zhi-Qiang Liu 《Chinese Chemical Letters》 SCIE CAS CSCD 2015年第5期590-594,共5页
In this study, seven alkaloids were detected in Wu-tou decoction using ultra performance liquid chromatography coupled with tandem mass spectrometry (UPLC-MSn). The aim of this study was to investigate the effect of... In this study, seven alkaloids were detected in Wu-tou decoction using ultra performance liquid chromatography coupled with tandem mass spectrometry (UPLC-MSn). The aim of this study was to investigate the effect of Fritillariae Cirrhosae Bulbus, Fritillariae Thunbergii Bulbus, Pinelliae Rhizoma in different ratios with Wu-tou decoction (2:1, 1:1, 1:2) by measuring the therapeutic effects in Wu-tou decoction of main seven alkaloids including benzoylaconitine (BA), benzoylmesaconitine (BM), benzoylhypaconitine (BH), hypaconitine (HA), fuziline (FU), niaolin (NE) and deoxyaconitine (DA). The permeability of aconitum alkaloids extract through a Caco-2 cell monolayer was analyzed in the absence and presence of Fritillariae Cirrhosae Bulbus, Fritillariae Thunbergii Bulbus, and Pinelliae Rhizoma, respectively. The results showed that Pinelliae Rhizoma could reduce the absorption of the alkaloids and increase the excretion of the alkaloids, which would attenuate the therapeutic effects of Wu-tou decoction. Therefore, Pinelliae Rhizoma is an incompatible herb of Wu-tou decoction because of the inhibition of the absorption of alkaloids in the intestine. And that Fritillariae Cirrhosae Bulbus and Fritillariae rhunbergii Bulbus showed the effects to improve the permeability of the alkaloids in Wu-tou decoction. These effects of these two herbs were similar, but the former was stronger than the latter, which most likely is due to the fact that the compositions of these two traditional Chinese medicines are similar. The in vitro data suggests that the compounds such as fritillary presented in alkaloids in the formula maybe improve the therapeutic function caused by the increased bioavailability of alkaloids in intestine. 展开更多
关键词 Wu-tou decoction Caco-2 cell Ultra performance liquid chromatographic coupled with tandem mass spectrometry (UPLC-MS/MS~) incompatible herbs
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Combined Use of NMR, LC-ESI-MS and Antifungal Tests for Rapid Detection of Bioactive Lipopeptides Produced by Bacillus 被引量:1
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作者 Mara Silva António Pereira +2 位作者 Dora Teixeira António Candeias Ana Teresa Caldeira 《Advances in Microbiology》 2016年第10期788-796,共9页
The science and technology interact with the art in several ways. Biotechnological coupled with analytical approaches can play an important role in protecting and preserving cultural heritage for future generations. M... The science and technology interact with the art in several ways. Biotechnological coupled with analytical approaches can play an important role in protecting and preserving cultural heritage for future generations. Many microorganisms influenced by environmental conditions are the main responsible for biological contamination in built heritage. Biocides based on chemical compounds have been used to mitigate this problem. Thus, it is vitally important to develop proper remediation actions based on environmentally innocuous alternative. Bacillus specie is emerging as an optimistic alternative for built heritage treatment due to their capacity to produce secondary metabolites with antagonistic activities against many fungal pathogens. Therefore, the intent of this work was to access a rapid evaluation of antifungal potential of bioactive metabolites produced by Bacillus strains and simultaneously their characterization using spectroscopic (NMR) and chromatographic techniques (LC-ESI-MS). The high antifungal activity obtained for Bacillus sp. active compounds produced in this study confirms the great potential to suppress biodeteriogenic fungi growth on historical artworks. Additionally, the proposed methodology allowed to access bioactive metabolites produced without need of the laborious total previous isolation and could be used as a viable alternative to be employed for screening and production of new green biocides. 展开更多
关键词 LIPOPEPTIDES Bacillus sp. Biodegradation/Biodeterioration Natural Biocides Nuclear Magnetic Resonance liquid Chromatography Coupled to Mass Spectrometry
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Deciphering the chemical profile and pharmacological mechanism of Jinlingzi powder(金铃子散)against bile reflux gastritis using ultra-high performance liquid chromatography coupled with Q exactive focus mass spectrometry,network pharmacology,and molecular docking 被引量:3
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作者 REN Hui ZHAO Lintao +5 位作者 GAO Kai YANG Yuanyuan CUI Xiaomin HU Jing CHEN Zhiyong LI Ye 《Journal of Traditional Chinese Medicine》 SCIE CSCD 2023年第6期1209-1218,共10页
OBJECTIVE:To elucidate the chemical profile and the pharmacological mechanism by which Jinlingzi powder(金铃子散,JLZP)treats bile reflux gastritis(BRG).METHODS:A BRG model was established in rats by oral administratio... OBJECTIVE:To elucidate the chemical profile and the pharmacological mechanism by which Jinlingzi powder(金铃子散,JLZP)treats bile reflux gastritis(BRG).METHODS:A BRG model was established in rats by oral administration of the model solution.JLZP was orally administered for 35 d.Residual gastric rate and tumor necrosis factor(TNF)-α,interleukin(IL)-6,and gastrin levels in the serum were measured,and stomach tissues were collected for histopathological analysis.We used ultra-high performance liquid chromatography coupled with Q Exactive Focus mass spectrometry to identify the chemical ingredients in JLZP.Then,protein-protein interaction and herb-compound-target networks were constructed to screen potential bioactive compounds and targets.Kyoto Encyclopedia of Genes and Genomes pathway analysis was then performed to elucidate the pathway involved in the JLZP-mediated treatment of BRG.After constructing the core compound-target-pathway interaction network,molecular docking was performed to study the binding free energy of core bioactive compounds and two candidate targets[RAC-alpha serine/threonine-protein kinase(AKT1)and phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform(PIK3CA)].RESULTS:JLZP extracts significantly promoted gastric emptying,regulating the release of cytokines(TNF-αand IL-6)and improving gastrin secretion and mucosal repair.Fifty-six compounds were tentatively characterized in JLZP.Moreover,the network pharmacology and molecular docking results showed that alkaloids and flavonoids might be the bioactive compounds in JLZP that treat BRG.JLZP might improve mucosal repair during BRG progression by modulating the phosphatidylinositol-4,5-bisphosphate 3-kinase-protein kinase B,hypoxia inducible factor-1,mitogen-activated protein kinase,forkhead box O,TNF,and IL-17 signaling pathways.CONCLUSIONS:We elucidated the chemical constituents and the pharmacological mechanism of JLZP in treating BRG and provided a basis for clinical application. 展开更多
关键词 bile reflux gastritis liquid chromatography coupled with mass spectrometry network pharmacology molecular docking simulation Jinlingzi powder
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An In vivo Metabolic Reaction-Based Mass Difference Screening Strategy for Comprehensive Metabolite Profiling of the Huangqi-Danshen Herb Pair Using Ultra-High-Performance Liquid Chromatography Coupled with Quadrupole-Time-of-Flight Mass Spectrometry
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作者 Chen-Xi Liu Xin-Lu Li +3 位作者 Cai-Yi Ma Meng Ding Ping Li Hua Yang 《World Journal of Traditional Chinese Medicine》 2025年第2期202-218,共17页
Objective:The absorbed prototypes and metabolites of traditional Chinese medicines in vivo are crucial for identifying their biological functions.However,comprehensive profiling of constituents in vivo is difficult ow... Objective:The absorbed prototypes and metabolites of traditional Chinese medicines in vivo are crucial for identifying their biological functions.However,comprehensive profiling of constituents in vivo is difficult owing to endogenous interference and low metabolite abundance.Therefore,a systematic strategy was proposed for screening and profiling exogenous components in biological matrices based on the mass differences between prototypes and the products of their metabolic reactions.Materials and Methods:Two hundred and forty-seven previously reported metabolic reactions were collected from the relevant literature on the Huangqi-Danshen(HD)herb pair,and a metabolic reaction-based mass difference database was created.The preprocessed data from experimental MS1based on ultra-high-performance liquid chromatography coupled with quadrupole-time-of-flight mass spectrometry were automatically calculated mass differences by R programming and matched with the database to screen potential constituents.Finally,the components were annotated across the MS2data.Results:A total of 164 components were annotated in the plasma samples from the rats after oral administration of HD,of which 20 were confirmed using the reference standards.The major metabolic pathways include methylation,dehydration,cysteine S-binding,glucuronidation,sulfation,and multistep reactions.Conclusions:This study revealed the metabolic characteristics and biotransformation regulation of HD and laid the foundation for elucidating its therapeutic effects.The proposed approach provides advantageous resources for evaluating the metabolites in the complex systems. 展开更多
关键词 Database screening huangqi-danshen herb pair mass difference metabolite profiling ultra-high-performance liquid chromatography coupled with quadrupole-time-of-flight mass spectrometry
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COMPREHENSIVE TWO-DIMENSIONAL LIQUID CHROMATOGRAPHY COUPLED WITH QUADRUPLE TIME-OF-FLIGHT MASS SPECTROMETRY FOR CHEMICAL CONSTITUENTS ANALYSIS OF TRIPTERYGIUM GLYCOSIDES TABLETS 被引量:11
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作者 Xiao Yao 《World Journal of Traditional Chinese Medicine》 2015年第4期66-66,共1页
Comprehensive two-dimensional liquid chromatography platform(LC×LC)coupled with quadrupole time-of-flight(QTOF)mass spectrometry(MS)is developed to separate,identify and relatively determine the chemical constitu... Comprehensive two-dimensional liquid chromatography platform(LC×LC)coupled with quadrupole time-of-flight(QTOF)mass spectrometry(MS)is developed to separate,identify and relatively determine the chemical constituents of two types of tripterygium glycosides tablets(TGT).The types and relative contents of the constituents discovered in two kinds of TGT tablets were subsequently compared.C8andC18 column were used for the separation of the first 展开更多
关键词 TGT COMPREHENSIVE TWO-DIMENSIONAL liquid CHROMATOGRAPHY COUPLED WITH QUADRUPLE TIME-OF-FLIGHT MASS SPECTROMETRY FOR CHEMICAL CONSTITUENTS ANALYSIS OF TRIPTERYGIUM GLYCOSIDES TABLETS
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Pharmacokinetic Comparison of Four Major Bio-Active Components of Naoxintong Capsule in Normal and Acute Blood Stasis Rats Using Ultra-Performance Liquid Chromatography Coupled with Triple-Quadrupole Mass Spectrometry 被引量:1
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作者 Wei-Xia Li Shu-Qi Zhang +5 位作者 Man-Man Li Hui Zhang Xiao-Yan Wang Lu Niu Jin-Fa Tang Xue-Lin Li 《World Journal of Traditional Chinese Medicine》 2022年第1期92-99,共8页
Objective: To compare the pharmacokinetic differences of the main components of Naoxintong capsule(NXTC) in normal and acute blood stasis rats. Materials and Methods: Rats were subcutaneously injected with adrenaline ... Objective: To compare the pharmacokinetic differences of the main components of Naoxintong capsule(NXTC) in normal and acute blood stasis rats. Materials and Methods: Rats were subcutaneously injected with adrenaline hydrochloride twice;during the two subcutaneous injections, the rats were placed in ice water for 4 min to reproduce the model rat of acute blood stasis. The normal and acute blood stasis rats were administrated a 5.04 g/kg dose of NXTC suspension. Then, blood samples were collected from the posterior retinal venous plexus at different time points. Plasma concentrations of four major bio-active components including caffeic acid, ferulic acid, formononetin, and tanshinone IIA in NXTC were measured using ultra-performance liquid chromatography coupled with triple-quadrupole mass spectrometry. Phoenix Win Nonlin v6.2 software was used to calculate the pharmacokinetic parameters. Results: Compared with the normal rats, the acute blood stasis rats showed a significant decrease in C_(max) of ferulic acid and formononetin, AUC_(all) of caffeic acid and ferulic acid, and AUC_(INF_obs) of ferulic acid. Conversely, an increase in the Vz_F_obs and MRT_(last) of ferulic acid and caffeic acid was observed. These findings demonstrate that the absorption of the four NXTC components was weakened in the acute blood stasis rats and that the elimination time was prolonged. Conclusions: The significant difference in some parameters of the four NXTC components between the normal and acute blood stasis rats might be caused by an increase in blood viscosity and the subsequent slowing down of blood flow in the acute blood stasis rats. The pharmacokinetic study conducted in pathological state can provide important information and scientific basis for further rational clinical application of NXTC. 展开更多
关键词 Acute blood stasis rat model Naoxintong capsules PHARMACOKINETICS ultra-performance liquid chromatography coupled with triple-quadrupole mass spectrometry
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Rapid Differentiation of Aconiti Kusnezoffii Radix from Different Geographic Origins Using Ultra-Performance Liquid Chromatography Coupled with Time-of-Flight Mass Spectrometry 被引量:1
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作者 En-Yu Lu Zi-Feng Pi +4 位作者 Zhong Zheng Shu Liu Feng-Rui Song Na Li Zhi-Qiang Liu 《World Journal of Traditional Chinese Medicine》 2021年第1期71-77,共7页
Objective:There are different geographic origins of Aconiti Kusnezoffii Radixs(AKRs)sold in the market with different quality.This study aims to establish a rapid analysis method to distinguish the different geographi... Objective:There are different geographic origins of Aconiti Kusnezoffii Radixs(AKRs)sold in the market with different quality.This study aims to establish a rapid analysis method to distinguish the different geographic origins of AKRs and to realize the rapid evaluation of their quality.Methods:An ultra-performance liquid chromatography coupled with time-of-flight mass spectrometry(UPLC-Q-TOF MS)method was utilized to acquire the constituents'information of AKRs from different geographic origins.MSE data and Progenesis QI software were employed to identify the chemical constitutes.Principal component analysis(PCA)was applied to comparing MS data to find the chemical markers of AKRs from different geographic origins.Results:Twenty-three components were detected and 17 out of them were identified,including diester-diterpenoid alkaloids,monoester-diterpenoid alkaloids,and amine-diterpenoid alkaloids.Three pairs of isomers were detected and two of them were distinguished by the retention time of standard samples.Thirteen chemical markers were screened out through PCA and orthogonal partial least square discriminant analysis.Through detecting Napelline or isomer of Napelline(m/z 360.2530)and Aconifine(m/z 662.3170),AKRs from inner Mongolia autonomous could be screened.According to the existence of benzoylaconine(m/z 604.3108)and Indaconitine(m/z 630.3159),it could be confirmed that the AKRs are from Xinjiang Uygur autonomous.AKRs that cannot detect compounds above-mentioned could be from Liaoning or Shanxi Province.Conclusions:The chemical profile could be used not only to distinguish the AKRs from different geographic origins but also to identify the true and false of AKRs.This study lays a foundation for the study of efficacy and toxic of AKRs. 展开更多
关键词 Aconiti Kusnezoffii Radix chemical markers rapid differentiation ultra-performance liquid chromatography coupled with time-of-flight mass spectrometry
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GLOBAL ANALYSIS OF THE METABOLITES OF CURCUMIN IN RATS BY ULTRA PERFORMANCE LIQUID CHROMATOGRAPHY COUPLED WITH QUADRUPOLE TIME OF-FLIGHT TANDEM MASS SPECTROMETRY
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作者 Feng Qiu Tianyi Qiu +2 位作者 Yang Yu Liqin Ding Xinchi Feng 《World Journal of Traditional Chinese Medicine》 2015年第4期100-101,共2页
Curcumin,a safe natural yellow pigment with a wide range of pharmacological activities,is used both in herbal drugs and as a food coloring agents.Studies have shown that curcumin would suffer from extensive metabolism... Curcumin,a safe natural yellow pigment with a wide range of pharmacological activities,is used both in herbal drugs and as a food coloring agents.Studies have shown that curcumin would suffer from extensive metabolism in vivoand the predominant metabolic pathways are reduction and conjugation.In order to comprehensively study the metabolism and enrich the metabolic profile of cxurcumin in vivo,we carried out this research.A systematic method with highly sensitive UPLC-Q/TOF-MS was established to analyze different biological samples of rats after 展开更多
关键词 GLOBAL ANALYSIS OF THE METABOLITES OF CURCUMIN IN RATS BY ULTRA PERFORMANCE liquid CHROMATOGRAPHY COUPLED WITH QUADRUPOLE TIME OF-FLIGHT TANDEM MASS SPECTROMETRY
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Screening Safflower Injection for Constituents with Activity against Stroke Using Comprehensive Chemical Profiling Coupled with Network Pharmacology 被引量:4
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作者 Xin-Yue Shi Qiu-Yun Miao +2 位作者 Xin-Guang Liu Ping Li Wen Gao 《World Journal of Traditional Chinese Medicine》 2021年第3期347-360,共14页
Objective:This study aimed to explore safflower injection(SI)for constituents with activity against ischemic stroke using a combination of chemical analysis and a network pharmacology strategy.Materials and Methods:Th... Objective:This study aimed to explore safflower injection(SI)for constituents with activity against ischemic stroke using a combination of chemical analysis and a network pharmacology strategy.Materials and Methods:The main ingredients of SI were comprehensively identified using ultra-high-performance liquid chromatography coupled with quadrupole time-of-flight tandem mass spectrometry,and the core targets and pathways associated with stroke were predicted using PharmMapper and Kyoto Encyclopedia of Genes and Genomes analysis.Cytoscape software was used to visualize and analyze the active compound-target-pathway network of SI regulating ischemic stroke.Results:A total of76 chemical compounds were identified from the SI sample,including 63,which regulated 88 targets that were ultimately enriched in 12 key ischemia stroke-related signaling pathways.Kaempferol-3-O-sophoroside,kaempferol-3-O-rutinoside,carthamoside B6,neoeriocitrin,and6-hydroxykaempferol-3-O-rutinoside-6-O-glucoside were determined to be important for stroke treatment because they had a higher degree value in the network than other constituents did.Moreover,the characteristic components isolated from SI showed protective effect mainly by acting on multiple targets including AKT1,epidermal growth factor receptor,transforming growth factor-beta receptor(TGFBR),Ras homolog,mTORC1 binding,caspase 3,and glycogen synthase kinase 3 beta,which were involved in different signaling pathways including phosphoinositide 3-kinase-Akt,mitogen-activated protein kinase,neurotrophin,ErbB,mechanistic target of rapamycin,and tumor necrosis factor.Conclusions:This study proposed a network pharmacology and chemical component profiling strategy for the systematic understanding of the therapeutic material basis of using SI against ischemic stroke. 展开更多
关键词 Chemical composition ischemic stroke network pharmacology safflower injection ultra-high-performance liquid chromatography coupled with quadrupole time-of-flight tandem mass spectrometry
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Free and Hidden Fumonisins in Hordei Fructus Germinatus and Their Transfer to the Decoction 被引量:3
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作者 Ling Hu Hai-Qiang Zhu +3 位作者 Mei-Lin Ni Jian Yang Chuan-Zhi Kang Lan-Ping Guo 《World Journal of Traditional Chinese Medicine》 2020年第1期106-111,共6页
Objective:This study aimed to determine the free and hidden fumonisins in Hordei Fructus Germinatus samples and to investigate the transfer rates of these mycotoxins from Hordei Fructus Germinatus to its decoction.Mat... Objective:This study aimed to determine the free and hidden fumonisins in Hordei Fructus Germinatus samples and to investigate the transfer rates of these mycotoxins from Hordei Fructus Germinatus to its decoction.Materials and Methods:The contamination levels of free and hidden fumonisins in a total of 60 Hordei Fructus Germinatus samples were analyzed using high-performance liquid chromatography coupled to tandem mass spectrometry(LC-MS/MS).The decoction procedure was simulated with a highly contaminated Hordei Fructus Germinatus sample,and fumonisins in the resulting decoction preparation were determined by LC-MS/MS.Results:Among all the samples,8.3%were contaminated with free fumonisins(FB1 and/or FB2)and 13.3%were contaminated with total fumonisins(free+hidden,measured as hydrolyzed fumonisins,i.e.,HFB1 and/or HFB2).The concentrations of FB1 and HFB1 reached up to 83 and 95μg/kg,respectively,whereas FB2 and HFB2 were detected only in traces.The transfer rates of free and total fumonisins from Hordei Fructus Germinatus to the decoction were 71.8%and 83.3%for FB1 and FB2,respectively.In comparison,much lower transfer rates were found for total fumonisins,i.e.,38.2%and 24.7%for HFB1 and HFB2,respectively.Conclusion:The incidence and contamination levels of free and hidden fumonisins in Hordei Fructus Germinatus samples were generally low.Regarding decoction preparation,the transfer rates of free fumonisins into the decoction were high,whereas a large part of hidden fumonisins were retained in Hordei Fructus Germinatus rather than migrating into water. 展开更多
关键词 DECOCTION FUMONISINS hidden fumonisins Hordei Fructus Germinatus liquid chromatography coupled to tandem mass spectrometry transfer rate
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