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Mónia Andreia Rodrigues Martins Estudos Para O
Universidade de Aveiro Departamento de Química 2017 MÓNIA ANDREIA ESTUDOS PARA O DESENVOLVIMENTO DE NOVOS RODRIGUES MARTINS PROCESSOS DE SEPARAÇÃO COM TERPENOS E SUA DISTRIBUIÇÃO AMBIENTAL STUDIES FOR THE DEVELOPMENT OF NEW SEPARATION PROCESSES WITH TERPENES AND THEIR ENVIRONMENTAL DISTRIBUTION Universidade de Aveiro Departamento de Química 2017 MÓNIA ANDREIA ESTUDOS PARA O DESENVOLVIMENTO DE NOVOS RODRIGUES MARTINS PROCESSOS DE SEPARAÇÃO COM TERPENOS E SUA DISTRIBUIÇÃO AMBIENTAL STUDIES FOR THE DEVELOPMENT OF NEW SEPARATION PROCESSES WITH TERPENES AND THEIR ENVIRONMENTAL DISTRIBUTION Tese apresentada à Universidade de Aveiro para cumprimento dos requisitos necessários à obtenção do grau de Doutor em Engenharia Química, realizada sob a orientação científica do Professor Doutor João Manuel da Costa e Araújo Pereira Coutinho, Professor Catedrático do Departamento de Química da Universidade de Aveiro, e do Professor Doutor Simão Pedro de Almeida Pinho, Professor Coordenador da Escola Superior de Tecnologia e Gestão do Instituto Politécnico de Bragança. Apoio financeiro da FCT e do FSE no âmbito do III Quadro Comunitário de Apoio (SFRH/BD/87084/2012). Aos meus pais. o júri presidente Prof. Doutor Joaquim Manuel Vieira professor catedrático no Departamento de Engenharia Cerâmica e do Vidro da Universidade de Aveiro Prof. Doutora Isabel Maria Almeida Fonseca professora associada com agregação da Faculdade de Ciências e Tecnologia da Universidade de Coimbra Prof. Doutor Héctor Rodríguez Martínez professor associado do Departamento de Engenharia Química da Universidade de Santiago de Compostela Prof. Doutor Luís Manuel das Neves Belchior Faia dos Santos professor associado da Faculdade de Ciências da Universidade do Porto Prof. Doutor Simão Pedro de Almeida Pinho professor coordenador na Escola Superior de Tecnologia e Gestão do Instituto Politécnico de Bragança Prof. -
WO 2019/014310 Al O
(12) INTERNATIONAL APPLICATION PUBLISHED UNDER THE PATENT COOPERATION TREATY (PCT) (19) World Intellectual Property Organization International Bureau (10) International Publication Number (43) International Publication Date WO 2019/014310 Al 17 January 2019 (17.01.2019) W !P O PCT (51) International Patent Classification: DZ, EC, EE, EG, ES, FI, GB, GD, GE, GH, GM, GT, HN, C07H 21/04 (2006.01) C12N 9/02 (2006.01) HR, HU, ID, IL, IN, IR, IS, JO, JP, KE, KG, KH, KN, KP, C07K 14/415 (2006.01) CI2N 9/88 (2006.01) KR, KW, KZ, LA, LC, LK, LR, LS, LU, LY, MA, MD, ME, C12N 1/16 (2006.01) CI2N 9/96 (2006.01) MG, MK, MN, MW, MX, MY, MZ, NA, NG, NI, NO, NZ, C12N 1/19 (2006.01) C12N 15/09 (2006.01) OM, PA, PE, PG, PH, PL, PT, QA, RO, RS, RU, RW, SA, CI2N 1/21 (2006.01) C12N 15/52 (2006.01) SC, SD, SE, SG, SK, SL, SM, ST, SV, SY, TH, TJ, TM, TN, C12N S/10 (2006.01) TR, TT, TZ, UA, UG, US, UZ, VC, VN, ZA, ZM, ZW. (21) International Application Number: (84) Designated States (unless otherwise indicated, for every PCT/US2018/041579 kind of regional protection available): ARIPO (BW, GH, GM, KE, LR, LS, MW, MZ, NA, RW, SD, SL, ST, SZ, TZ, (22) International Filing Date: UG, ZM, ZW), Eurasian (AM, AZ, BY, KG, KZ, RU, TJ, 11 July 2018 ( 11.07.2018) TM), European (AL, AT, BE, BG, CH, CY, CZ, DE, DK, (25) Filing Language: English EE, ES, FI, FR, GB, GR, HR, HU, IE, IS, IT, LT, LU, LV, MC, MK, MT, NL, NO, PL, PT, RO, RS, SE, SI, SK, SM, (26) Publication Language: English TR), OAPI (BF, BJ, CF, CG, CI, CM, GA, GN, GQ, GW, (30) Priority Data: KM, ML, MR, NE, SN, TD, TG). -
Molecular Electrostatic Potential of the Main Monoterpenoids Compounds Found in Oil Lemon Tahiti - (Citrus Latifolia Var Tahiti)
Parana Journal of Science and Education, v.1, n.1, November 17, 2015 c Copyright PJSE, 2015 Molecular electrostatic potential of the main monoterpenoids compounds found in oil Lemon Tahiti - (Citrus Latifolia Var Tahiti) R. Gobato1, A. Gobato2 and D. F. G. Fedrigo3 Abstract The work is a study of the geometry of the molecules via molecular mechanics of the main monoterpenoids found in the oil of Lemon Tahiti. Lemon Tahiti is the result of grafting of Persia file on Rangpur lime and has no seeds. A computational study of the molecular geometry of the molecules through molecular mechanics of the main monoterpenoids compounds present in fruit oil is described in a computer simulation. The fruit has active terpenoids compounds: a-pinene, b-pinene, limonene and g-terpenine. The studied monotepernoides form two groups of distribution characteristics of fillers and similar electrical potentials between groups. Since a-pinene and limonene present, major and minor moment of electric dipoles, respectively. Keywords Citrus Latifolia, Citrus essential oil, Lemon Tahiti, Limonene, a-Pinene, b-Pinene, g-Terpinene, Molecular Geometry, Molecular Mechanics. 1Secretaria de Estado da Educac¸ao˜ do Parana´ (SEED/PR), Av. Maringa,´ 290, Jardim Dom Bosco, Londrina/PR, 86060-000, Brasil. 2Faculdade Pitagoras´ Londrina, Rua Edwy Taques de Araujo,´ 1100, Gleba Palhano, Londrina/PR, 86047-500, Brasil. 3Aeronautical Engineering Consulting Consultant in processes LOA/PBN RNAV, Rua Lu´ısa, 388s, ap. 05, Vila Portuguesa, Tangara´ da Serra/MT, 78300-000, Brasil. Corresponding authors: [email protected]; [email protected]; [email protected] Contents References9 Introduction1 Introduction 0.1 Tree................................2 0.2 Scientific classification...................2 Fruits Lemon Tahiti - Citrus Latifolia var Tahiti. -
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[INDEX [ A Acid-catalyzed dehydration, of alcohols, Addition reactions, 337–390 303–308 Absolute configuration, 229–231 of alkenes, 338–373 Acid-catalyzed esterification, 778–780 Absorption spectrum, 590 Adduct, 599 Acid-catalyzed halogenation, of aldehydes Acetals, 728–730 Adenosine diphosphate (ADP), 423 and ketones, 818 Adenosine triphosphate (ATP), 274, 423, Acetaldehyde, 10, 72, 76, 78, 372, 714 Acid-catalyzed hemiacetal formation, 967–968 Acetaldehyde enolate, 53 726–727 Adenylate cyclase, 1095 physical properties, 10 Acid-catalyzed hydration, of alkenes, 354, Adipic acid, 765 Acetic acid, 73–74, 76, 78, 113, 118–119, 496–497 Adipocytes, 1016 126–128, 147, 762 Acid chlorides, see Acyl chlorides Adrenaline, 273, 899 physical properties, 78 Acid derivatives, synthesis of, 775 Adrenocortical hormones, 1032 and pK , 114 a Acidic hydrolysis of a nitrile, 790–791 Adriamycin, see Doxorubicin Acetoacetic ester synthesis, 825–830 Acidity: Agent Orange, 643–644 acylation, 829–830 carboxylic acids vs. alcohols, 126–132 Aggregation compounds, 163 dialkylation, 826 effect of solvent on, 132 Aglycone, 974–975 substituted methyl ketones, 826–827 hybridization, 122–123 Alanine, 909, 1048, 1051 Acetone, 14, 57, 72, 79, 711 inductive effects, 123 isoelectric point of, 1051 Acetonides, 979, 1007–1008 relationships between structure and, titration curve for, 1052 Acetonitrile, 75 120–123 Albrecht, Walther, 608–609 Acetylcholine, 890–891, 900–901 Acidity constant (Ka), 113–114 Albuterol, 492 Acetylcholinesterase, 900, 1081 Acid strength, 113 Alcohols, -
Computational Analysis, Visualization and Text Mining of Metabolic Networks
COMPUTATIONAL ANALYSIS, VISUALIZATION AND TEXT MINING OF METABOLIC NETWORKS by XINJIAN QI Submitted in partial fulfillment of the requirements For the degree of Doctor of Philosophy Dissertation Advisor: Dr. Gültekin Özsoyoğlu Department of Electrical Engineering and Computer Science CASE WESTERN RESERVE UNIVERSITY January, 2014 CASE WESTERN RESERVE UNIVERSITY SCHOOL OF GRADUATE STUDIES We hereby approve the thesis/dissertation of ____Xinjian Qi____________________________________________ candidate for the Doctor of Philosophy___degree *. (signed) __Dr. Gültekin Özsoyoğlu__________________________ (chair of the committee) __________Dr. Andy Podgurski______________________________ __________Dr. M. Cenk Cavusoğlu__________________________ __________Dr. Nicola Lai___________________________________ __________Dr. Z. Meral Özsoyoğlu__________________________ ___________________________________________________________ (date) _____June 24, 2013____ *We also certify that written approval has been obtained for any proprietary material contained therein. Table of Contents Table of Contents ................................................................................................................ 1 List of Tables ...................................................................................................................... 6 List of Figures ..................................................................................................................... 7 Acknowledgements .......................................................................................................... -
Copyrighted Material
[ INDEX ] A Brønsted–Lowry acids and bases, Acyl substitution, 771, 784–786, 822 Absolute configuration, 228–230 105–106 by nucleophilic addition–elimination, Absorption spectrum, 599 opposite charges attract, 135 784–786 Acetaldehyde, 10, 72, 76, 78, 372, 723 predicting the outcome of, 118–120 Acyl transfer reactions, 784 Acetaldehyde enolate, 53 and the synthesis of deuterium and Acylation, 839–840 physical properties, 10 tritium-labeled compounds, Acylation reaction, 678 Acetals, 738–740 134–135 Acylium ions, 437 Acetic acid, 73–74, 76, 78, 113, 118–119, water solubility as the result of salt Adamantane, 180 126, 128, 145, 772 formation, 119–120 Addition polymers, 483, 808 physical properties, 78 Acidic hydrolysis of a nitrile, 801 Addition reaction, 337–390 Acidity: and pKa , 114 of alkenes, 338–340 Acetoacetic ester synthesis, 835–840 effect of solvent on, 130 Adduct, 608 acylation, 839–840 effect of the solvent on, 130 Adenosine diphosphate (ADP), 431 dialkylation, 836 hybridization, 122–123 Adenosine triphosphate (ATP), 273, 431, substituted methyl ketones, 836–837 inductive effects, 123 981–982 Acetone, 14, 57, 72, 79, 720 relationships between structure and, Adenylate cyclase, 1110 Acetonides, 993, 1023 120–123 Adipic acid, 776 Acetonitrile, 75 Acidity constant (Ka ), 113–114 Adipocytes, 1032 Acetyl-coenzyme A, 784 Acids: Adrenaline, 273, 906 Acetyl group, 722 alcohols as, 509 Adrenocortical hormones, 1046 Brønsted–Lowry, 105–106, 137 Acetylcholine, 897–898, 908 Adriamycin, See Doxorubicin Lewis, 102–104 Acetylcholinesterase,