Background : Morus alba L. (M. alba L.), belonging to the family Moraceae, is widely distributed in East Asia. Fruits of M. alba L. have been used in traditional herbal medicine due to their antioxidant, anticancer, and antidiabetic properties. Phenolics play a main role for the growth, development, and pigment accumulation of plants. In this study, metabolic profiling of white (M. alba L. ‘Turkey’) and red (M. alba L. ‘Cheongil’) fruits during maturation. Methods and Results : Phenolic compounds are secondary metabolites found in most of the higher plants. In the current study, the levels of phenolic compounds decreased during the maturation of Turkey and Cheongil fruits. Particularly, the Turkey fruits showed a dramatic decrease in the accumulation of phenolics. Principal component analysis (PCA) is one of powerful tools to identify overall patterns in the multivariat experimental data. The PCA score plots results revealed a clear classification between Cheongil and Turkey. Additioanlly, each group spread left to right in the X-axis by maturity. Two principal components of the score plot explained 71.1% of the total variance. Principal component 1 was associated with the separation of each group by maturity and isolation of Turkey 1. Conclusion : In this study, we investigated primary metabolites and secondary metabolites (phenolics) in the white fruits (M. alba L. ‘Turkey’) and red fruits (M. alba L. ‘Cheongil’) in order to provide information on change in metabolite patterns during maturation.

Background : Galantamine is mainly obtained from the bulbs and flowers of Galanthus caucasicus, Galanthus woronowii, and other related genera such as Narcissus tazetta, Narcissus pseudonarcissus, Leucojum aestivum, and Lycoris radiata. Galantamine is used to treat Alzheimer’s disease (AD) and as an AD painkiller. Narcissus tazetta (N. tazetta), belonging to the Amaryllidaceae family, is a ornamental plant containing galantamine. In this study, metabolic profiling of N. tazetta different organs was performed. Methods and Results : The amount of galantamine in bulb of N. tazetta is the highest levels. About 0.61 ± 0.09 ㎎/g in bulb, 0.15 ± 0.17 ㎎/g in root, and 0.10 ± 0.0 ㎎/g in leaf. Contents of galantamine in root and leaf are not statistically significant. The total phenolic contents in leaf are the highest level. Rutin and kaempferol are identified all part of N. tazetta. On the other hands, 4-hydroxybenzoic acid is existed in leaf and caffeic acid is only existed in root. None of the bulbs except rutin and kaempferol are identified. Because plant secondary metabolism is closely related to plant primary metabolism, we used GC-TOF-MS on the levels of hydrophilic low-molecular-weight molecules in the N. tazetta. A total of 41 metabolites, including sugars, amino acids, organic compounds, and phenolic acids, were identified and measured, and the resulting quantitative data were subjected to principal components analysis (PCA). The results of PCA of metabolic profiles clearly showed the lack of marked variance among different organs of L. radiata. Two principal components of the score plot explained 86.79% of the total variance (component 1; 55.40%, component 2; 31.39%). Component 1 resolved the separation of leaves from the other plant parts. Conclusion : Narcissus tazetta belongs to amaryllidaceae family. These family has various alkaloids, in particular, galantamine is beneficial to Alzheimer patients. All parts of N. tazetta produce galantamine, in particular, the highest level is existed in the bulb. In contrast, phenolic compounds are identified

Background : Members of Amaryllidaceae family produce several alkaloids with unique structures and a variety of medicinal properties. Galantamine, in particular, is one of the alkaloids approved by the Food and Drug Administration (FDA), and the European Registration Bureau for treatment of Alzheimer’s disease. Lycoris radiata (L. radiata), belonging to the Amaryllidaceae family, is a bulbous plant containing galantamine, which exhibits selective and dominant acetylcholinesterase inhibition. In this study, metabolic profiling of L. radiata different organs was performed. Methods and Results : Galantamine in root, bulb, and leaf of L.radiata analyzed by high performance liquid chromatography (HPLC). The amount of galantamine in leaf is about 1.07 ± 0.17 ㎎/g and it is the higher than bulb (0.88 ± 0.01 ㎎/g) and root (0.75 ± 0.01 ㎎/g). These results are statistically significant. Six phenolics are identified in L. radiata through high performance liquid chromatography. Total amounts of phenolics are the highest in bulb. Because plant secondary metabolism is closely related to plant primary metabolism, we used GC-TOF-MS on the levels of hydrophilic low-molecular-weight molecules in the L. radiata. A total of 41 metabolites, including sugars, amino acids, organic compounds, and phenolic acids, were identified and measured, and the resulting quantitative data were subjected to principal components analysis (PCA). The results of PCA of metabolic profiles clearly showed the lack of marked variance among different organs of L. radiata. Two principal components of the score plot explained 89.4% of the total variance (component 1, 51.86%; component 2, 37.54%). Component 1 resolved the separation of leaves from the other plant parts. Conclusion : Amaryllidaceae family synthesize galantamine belonging to alkaloids. Particularly, in bulb of Lycoris radiata, galantamine contents are the highest level. Thus, bulb is very beneficial for Alzheimer’s disease because the galantamine is well known as treatment of dementia of Alzheimer type.

Background : To evaluate the quality of Glycyrrhizae radix (licorice), a popular herbal medicine in Korea, it is necessary to investigate the component profiles of the Glycyrrhiza species distributed in Korean market. Specifically, to control the quality of Korean Glycyrrhizae radix preparations including raw materials, glycyrrhizin (> 2.5%) and liquiritigenin (> 0.7%) has been used as a standard marker compound in Korea Food and Drug Administration (KFDA). To the best of our knowledge, there have been only a few studies regarding the fingerprinting techniques and metabolomics approach of the phytochemicals in Glycyrrhizae radix in Korean market. Therefore, it is necessary to develop a validated method for botanical raw material (BRM) standardization. Methods and Results : Twenty-one Glycyrrhizae radix (G. glabra, G. uralensis, and G. glabra × G. uralensis) were analyzed by UPLC-QTOF-MS and were estimated to statistical and multivariate analysis. Large scale multi-targeted metabolic profiling and fingerprinting techniques were utilized to access a broader insight into the chemical composition of Glycyrrhiza species. The UV/VIS spectra, and MS data (accurate mass and fragmentation pattern in negative mode) of the components in the BRM of G. glabra, G. uralensis, and G. glabra × G. uralensis (incorporation and hybridization) were analyzed with multivariate analyses. Interestingly, UPLC-QTof-MS derived PCA analysis and fingerprinting techniques was found to be effective techniques in the classification of species based on genetic and/or geographical origins. In addition, the revealed metabolite markers could be utilized as a guidance for the BRM standardization as well as a database for quality control of commercial products containing Glycyrrhizae radix. Conclusion : From the above results, the revealed metabolite markers could be utilized as a guidance for the BRM standardization as well as a database for quality control of commercial products containing Glycyrrhizae radix.

Background : This study was performed to investigate the morphological and growth characteristics and metabolomics approach for the diploid and tetraploid Polygonum multiflorum Thunb (PMT). Methods and Results : The present study was performed to investigate the effective induction method of tetraploid plants using colchicine treatment. To know the morphological and growth characteristics of PMT overground growing was investigated about the stem diameter, leaf length and width, a scape, inflorescence length, chlorophyll, seed length and seed width. Metabolite profiles from P. multiflorum were analyzed by an ultra performance liquid chromatography–quadrupole - time of flight (UPLC-Q-TOF) mass spectrometry (MS). The number of stomata and chlorophyll content was also higher in tetraploid. However, the physiological and morphological characteristics of the newly developed tetraploid showed noticeable results compared to the diploid plant. Also, the inherent characteristics of a newly acquired tetraploid also exhibited better results compared to diploid. Twenty one compounds including catechins from leaf and thirty compounds including stilbenes from roots were identified as major metabolites of PMT. The levels of most root metabolites except dethiobiotin, epigallocatechin gallate, procyanidin B1, epiafzelechin 3-O-gallate, and moupinamide from PMT were higher than those of diploid. The levels of 2,3-digalloylglucose, fallacinol, tricin, physcion-8-O-β-D-glucoside, torachrysone-8-O-β-D-glucopyranoside, questin, aloe-emodin 8-O-(6′-O-acetyl)-glucoside, polydatin, 2,5-dimethyl-7-hydroxychromone, 3,5,4'-trihydroxystilbene, aloe-emodin, myrciacitrin II and ω-hydroxyemodin from teraploid PMT were 342, 32, 31, 21, 11, 11, 9, 8, 6, 5, 4, and 2 times, respectively, higher. Conclusion : From above results, overground growing of tetraploid P. multiflorum is fairly better than that of native P. multiflorum.

Background : The genus of Mentha contains more than 25 species and has been used as cuisines, medicines, cosmetics, oral hygiene products, pharmaceuticals, pesticides, and flavor enhancing agent. Due to economical value of these species, many studies have identified and isolated the beneficial constituents such as flavonoids, terpenoids, and volatile compounds. In this study, the primary and secondary metabolites were investigated from the aerial parts of nine different Mentha species including peppermint (M. piperita), pennyroyal mint (M. pulegium), spearmint (M. spicata), horse mint (M. longifolia), water mint (M. aquatica), apple mint, pineapple mint (M. suaveolens), and chocolate mint, eau de cologne mint (M x piperita hybrids). Also, we reported the antioxidant properties using extracts of obtained plants. Methods and Results : In total, 67 metabolites were detected using gas chromatography time-of-flight mass spectrometry (GC-TOFMS). The difference among nine Mentha spp. by principal components analysis has been investigated. Various phenoilic compounds and carotenoids were characterized quantified in Mentha plants by HPLC. Of these, rosmarinic acid was found to be rich in most of this family. In addition, the highest content of riboflavin were indicated in spearmint. Moreover, the highest antioxidant activities (88.6 % 100 μl/ml in DPPH assay, 76.2% 100 μl/ml in hydrogen peroxide radical scavenging activity, and 0.076 absorbance in reducing power assay) have been shown in horse mint. Conclusion : We determined the differences in accumulation of primary and secondary metabolites (phenolic compound, carotenoid, and riboflavin) among nine Mentha species. Totally, 67 primary metabolites were identified and compared the difference by principal components analysis. Besides, horse mint has the highest and strongest antioxidant activities compared to others.

Background : Despite the presence of various bioactive compounds in ginseng, there is lack of study about the phenolic metabolites in ginseng especially depending on the cultivation soil and the fertilizer types. Therefore, this study aims to develop an (-)ESI-LC-MS/MS analytical method for the measurement of selected phenolic compounds in the ginseng root. Methods and Results : Total phenol content in ginseng root was measured with the Folin-Ciocalteau method using UV/Vis spectrophotometer. Then, the 56 selected phenolic metabolites in ginseng root were measured with the (-)ESI-LC-MS/MS. The brief LC-MS/MS analytical conditions were as follows; Thermo Scientific Syncronis C18 HPLC Column (250 × 4.6 mm, 5 μm) was used. Optimized instrument settings were as follows: Curtain gas 20 psi, collision gas 2 psi, ion spray voltage –4500 V, nebulizer gas 40 psi, heating gas 70 psi, and its temperature 350℃. Total phenol content was higher in the ginseng cultivated in the paddy-converted field than that in upland. In particular, the total phenol content was about 6% decreased in the ginseng root cultivated with the food waste fertilizer compared to the control (p < 0.05). Six phenolic constituents including caffeic, chlorogenic, p-coumaric, ferulic, gentisic, and salicylic acids were found in the ginseng root by using the LC-MS/MS in MRM (multiple reaction monitoring) Mode. These six phenolic compounds occupied approximately 20% of the total phenol content measured in the corresponding ginseng root. The chlorogenic acid was the most abundant phenolic metabolite found in the ginseng root, accounting for ≥ 95% of the sum of six phenolic compounds, in this study. Conclusion : This preliminary study can be useful for the study on content and composition of phenolic metabolites in ginseng root with the aspect of metabolomics. We plan to further optimize the LC-MS/MS analytical method and then provide the extended understanding on the phenolic metabolism in the ginseng root with respect to the ginseng cultivation conditions.

Background: A set of logical criteria that can accurately identify and verify the cultivation region of raw materials is a critical tool for the scientific management of traditional herbal medicine. Methods and Results: Volatile compounds were obtained from 19 and 32 samples of Angelica gigas Nakai cultivated in Korea and China, respectively, by using steam distillation extraction. The metabolites were identified using GC/MS by querying against the NIST reference library. Data binning was performed to normalize the number of variables used in statistical analysis. Multivariate statistical analyses, such as Principal Component Analysis (PCA), Partial Least Squares-Discriminant Analysis (PLS-DA), and Orthogonal Partial Least Squares-Discriminant Analysis (OPLS-DA) were performed using the SIMCA-P software. Significant variables with a Variable Importance in the Projection (VIP) score higher than 1.0 as obtained through OPLS-DA and those that resulted in p-values less than 0.05 through one-way ANOVA were selected to verify the marker compounds. Among the 19 variables extracted, styrene, α-pinene, and β-terpinene were selected as markers to indicate the origin of A. gigas. Conclusions: The statistical model developed was suitable for determination of the geographical origin of A. gigas. The cultivation regions of six Korean and eight Chinese A. gigas. samples were predicted using the established OPLS-DA model and it was confirmed that 13 of the 14 samples were accurately classified

본 연구는 rutin 및 rutin 대사체인 DHPAA, HPAA, DHT, HVA가 버섯 유래 tyrosinase 활성과 마우스 피부표피 세포주인 JB6 P+ 세포의 증식에 미치는 영향에 대해 살펴보았다. HVA가 버섯유래 티로시나제 저해활성이 가장 우수한 것으로 관찰되었으며, DHPAA, HPAA, rutin, DHT 순서로 저해효능을 나타내었다. DHT를 제외한 rutin 및 rutin 대사체들 모두 100 μM 까지 세포 독성이 관찰되지 않은 것으로 관찰되었으며, DHT는 50 또는 100 μM에서 세포증식을 저해하였으나 그 이하의 농도에서는 세포독성을 유도하지 않았다. 따라서 본 연구결과, rutin 대사체 모두 세포 독성이 없는 수준에서 버섯 유래 티로시나제 활성을 효과적으로 억제하였으므로, 앞으로 미백제제로 활용될 수 있을 것으로 기대된다.

잔디는 운동장과 골프장, 공원, 묘지 등의 다양한 장소에 식재되는 주요 원예작물이다. 국내에 자생하는 한국잔디(Zoysiagrass)로는 들잔디(Zoysia japonica)와 금잔디(Zoysia matrella), 갯잔디(Zoysia sinica) 등이 있다. 주요 원예작물에 대한 대사체 분석은 다양하게 연구가 이루어지고 있지만 아직 잔디의 대사체 성분 분석은 거의 이루어진 바 없다. FTIR(Fourier Transform Infrared Spectroscopy)은 적외선을 통해 얻어지는 sample의 흡광도를 이용하여, 해당 시료의 성분 및 양을 측정할 수 있는 기법으로써, HPLC와 같은 기존의 대사체 분석 방법 보다 쉽고 빠르게 결과를 알 수 있어 최근 다양한 분야에서 사용되고 있다. 따라서 본 연구에서는 다년간 수집된 국내 자생 잔디(들잔디, 금잔디, 갯잔디) 약 240점의 FTIR분석을 통해 대사체 수준에서 자생 잔디의 식별체계를 확립하고자 하였다. PCA(principal component analysis)와 PLS-DA(Partial least square discriminant analysis)분석 결과, 갯잔디는 들잔디와 금잔디 라인들과 뚜렷하게 식별되었으며 PCA dendrogram에서도 같은 결과를 얻을 수 있었다. 이를 통해 갯잔디의 대사체 성분들이 들잔디와 금잔디와 비교하여 매우 다른 특징을 가지고 있음을 알 수 있었다. 수집지별로 들잔디 라인들의 PCA 분석결과에서는 산악지대와 해안지대에 서식하는 잔디가 식별되는 경향을 보였으며, PLS-DA와 PLS-DA dendrogram 분석결과에서는 두 그룹이 더욱 뚜렷하게 구분되어 서식지에 따른 들잔디의 대사산물의 패턴 차이가 크게 나타남을 확인할 수 있었다.

Ginsenosides of roots in Panax ginseng were analyzed by metabolic-targeting HPLC using the partial leastsquares discriminant analysis (PLS-DA) and compared depending on sowing methods between direct seeding andtransplanting method. Score plots derived from PLS-DA could identify the sowing method between the direct seeding andtransplanting method in P. ginseng roots. The ginsenoside compounds were assigned as Rg1, Re, Rf, Rg2, Rb1, Rc,Rb2, Rb3, and Rd. Contents of Re, Rf, Rg2, Rb1, Rc, Rb3, and Rd of main roots produced from the transplanting methodwere relatively higher than those of samples produced from direct seeding method. Also, contents of Rg1, Re, Rf, Rg2, Rb1,Rc, Rb2, Rb3, and Rd of lateral roots from the transplanted samples were relatively higher than those of samples producedfrom direct seeding method. Therefore, HPLC with PLS-DA analysis can be a straightforward tool for identificationof ginsenosides in main or lateral roots of P. ginseng obtained from two different seeding methods between directand transplanting methods.