PMID- 31374422
OWN - NLM
STAT- MEDLINE
DCOM- 20191211
LR  - 20221207
IS  - 1873-376X (Electronic)
IS  - 1570-0232 (Linking)
VI  - 1125
DP  - 2019 Sep 1
TI  - Multi-residue method for enantioseparation of psychoactive substances and beta 
      blockers by gas chromatography-mass spectrometry.
PG  - 121731
LID - S1570-0232(19)30477-5 [pii]
LID - 10.1016/j.jchromb.2019.121731 [doi]
AB  - Currently, consumption of illicit drugs and pharmaceuticals has increased 
      significantly. Many of these substances are chiral and can be available as 
      racemates or enantiomerically pure. Determination of the enantiomeric fraction 
      (EF) in wastewater is useful for: i) distinguishing between the consumption of 
      prescribed and illicit drugs; ii) identification of possible local of illegal 
      synthesis; iii) illegal discharge of sewage and estimation of illicit drugs and 
      pharmaceuticals consumption by a community (wastewater-based epidemiology). This 
      work describes the development of an indirect method by gas chromatography-mass 
      spectrometry (GC-MS) for enantiomeric quantification of chiral substances namely 
      psychoactive drugs and beta-blockers based on the formation of diastereomers using 
      (R)-(-)-alpha-methoxy-alpha-(trifluoromethyl)phenylacetyl chloride ((R)-MTPA-Cl) as 
      chiral derivatization reagent. The developed method presented linearity 
      (R(2) > 0.99) for 20 compounds, 9 diastereomer pairs and paroxetine (PAR) and 
      sertraline (SER). Recovery ranged from 80.7 to 114.5% (RSD < 9.1%) and accuracy 
      between 84.6 and 118% (RSD < 9.9%). The limits of detection (LOD) varied from 
      0.03 and 26.0 ngL(-1) and limits of quantification (LOQ) from 0.15 and 104 
      ngL(-1). Results showed the occurrence of amphetamine (AMP), illicit drugs as 
      3,4-methylenedioxymethamphetamine (MDMA) and methamphetamine (MAMP), alprenolol 
      (ALP), norfluoxetine (NFLX), (SER), metoprolol (MET) and propranolol (PHO) at 
      concentrations ranging from 21.7 ngL(-1) (MDMA) to 622 ngL(-1) (PHO). Measured 
      concentrations were used to estimate the drug loads of the target chiral 
      substances in a specific population. The EF was determined providing valuable 
      information about the consumption and origin of the target drugs.
CI  - Copyright (c) 2019 Elsevier B.V. All rights reserved.
FAU - Goncalves, Ricardo
AU  - Goncalves R
AD  - CESPU, Instituto de Investigacao e Formacao Avancada em Ciencias e Tecnologias da 
      Saude, Rua Central de Gandra, 1317 Gandra, PRD, Portugal; Laboratorio de Quimica 
      Organica e Farmaceutica, Departamento de Ciencias Quimicas, Faculdade de 
      Farmacia, Universidade do Porto, Rua de Jorge Viterbo Ferreira, 228, Porto, 
      Portugal.
FAU - Ribeiro, Claudia
AU  - Ribeiro C
AD  - CESPU, Instituto de Investigacao e Formacao Avancada em Ciencias e Tecnologias da 
      Saude, Rua Central de Gandra, 1317 Gandra, PRD, Portugal; Centro Interdisciplinar 
      de Investigacao Marinha e Ambiental (CIIMAR), Terminal de Cruzeiros do Porto de 
      Leixoes, Avenida General Norton de Matos, s/n, Matosinhos, Portugal.
FAU - Cravo, Sara
AU  - Cravo S
AD  - Laboratorio de Quimica Organica e Farmaceutica, Departamento de Ciencias 
      Quimicas, Faculdade de Farmacia, Universidade do Porto, Rua de Jorge Viterbo 
      Ferreira, 228, Porto, Portugal; Centro Interdisciplinar de Investigacao Marinha e 
      Ambiental (CIIMAR), Terminal de Cruzeiros do Porto de Leixoes, Avenida General 
      Norton de Matos, s/n, Matosinhos, Portugal.
FAU - Cunha, Sara C
AU  - Cunha SC
AD  - LAQV-Requimte, Laboratorio de Bromatologia e Hidrologia, Departamento de Ciencias 
      Quimicas, Faculdade de Farmacia, Universidade do Porto, Rua de Jorge Viterbo 
      Ferreira, 228, Porto, Portugal.
FAU - Pereira, Jose Augusto
AU  - Pereira JA
AD  - Centro Interdisciplinar de Investigacao Marinha e Ambiental (CIIMAR), Terminal de 
      Cruzeiros do Porto de Leixoes, Avenida General Norton de Matos, s/n, Matosinhos, 
      Portugal; ICBAS-Instituto de Ciencias Biomedicas Abel Salazar, Universidade do 
      Porto, Rua de Jorge Viterbo Ferreira, 228, 4050-313 Porto, Portugal.
FAU - Fernandes, J O
AU  - Fernandes JO
AD  - LAQV-Requimte, Laboratorio de Bromatologia e Hidrologia, Departamento de Ciencias 
      Quimicas, Faculdade de Farmacia, Universidade do Porto, Rua de Jorge Viterbo 
      Ferreira, 228, Porto, Portugal.
FAU - Afonso, Carlos
AU  - Afonso C
AD  - Laboratorio de Quimica Organica e Farmaceutica, Departamento de Ciencias 
      Quimicas, Faculdade de Farmacia, Universidade do Porto, Rua de Jorge Viterbo 
      Ferreira, 228, Porto, Portugal; Centro Interdisciplinar de Investigacao Marinha e 
      Ambiental (CIIMAR), Terminal de Cruzeiros do Porto de Leixoes, Avenida General 
      Norton de Matos, s/n, Matosinhos, Portugal.
FAU - Tiritan, Maria Elizabeth
AU  - Tiritan ME
AD  - CESPU, Instituto de Investigacao e Formacao Avancada em Ciencias e Tecnologias da 
      Saude, Rua Central de Gandra, 1317 Gandra, PRD, Portugal; Laboratorio de Quimica 
      Organica e Farmaceutica, Departamento de Ciencias Quimicas, Faculdade de 
      Farmacia, Universidade do Porto, Rua de Jorge Viterbo Ferreira, 228, Porto, 
      Portugal; Centro Interdisciplinar de Investigacao Marinha e Ambiental (CIIMAR), 
      Terminal de Cruzeiros do Porto de Leixoes, Avenida General Norton de Matos, s/n, 
      Matosinhos, Portugal. Electronic address: elizabeth.tiritan@iucs.cespu.pt.
LA  - eng
PT  - Evaluation Study
PT  - Journal Article
DEP - 20190724
PL  - Netherlands
TA  - J Chromatogr B Analyt Technol Biomed Life Sci
JT  - Journal of chromatography. B, Analytical technologies in the biomedical and life 
      sciences
JID - 101139554
RN  - 0 (Adrenergic beta-Antagonists)
RN  - 0 (Psychotropic Drugs)
RN  - 0 (Sewage)
RN  - 0 (Waste Water)
RN  - 0 (Water Pollutants, Chemical)
RN  - 44RAL3456C (Methamphetamine)
RN  - CK833KGX7E (Amphetamine)
SB  - IM
MH  - Adrenergic beta-Antagonists/*chemistry/isolation & purification
MH  - Amphetamine/chemistry/isolation & purification
MH  - Gas Chromatography-Mass Spectrometry/*methods
MH  - Limit of Detection
MH  - Methamphetamine/chemistry/isolation & purification
MH  - Psychotropic Drugs/*chemistry/isolation & purification
MH  - Sewage/chemistry
MH  - Stereoisomerism
MH  - Wastewater/chemistry
MH  - Water Pollutants, Chemical/chemistry/isolation & purification
OTO - NOTNLM
OT  - Chiral drugs
OT  - Diastereomers
OT  - Pharmaceuticals
OT  - Wastewater
OT  - Wastewater-based epidemiology
EDAT- 2019/08/03 06:00
MHDA- 2019/12/18 06:00
CRDT- 2019/08/03 06:00
PHST- 2019/03/22 00:00 [received]
PHST- 2019/07/22 00:00 [revised]
PHST- 2019/07/23 00:00 [accepted]
PHST- 2019/08/03 06:00 [pubmed]
PHST- 2019/12/18 06:00 [medline]
PHST- 2019/08/03 06:00 [entrez]
AID - S1570-0232(19)30477-5 [pii]
AID - 10.1016/j.jchromb.2019.121731 [doi]
PST - ppublish
SO  - J Chromatogr B Analyt Technol Biomed Life Sci. 2019 Sep 1;1125:121731. doi: 
      10.1016/j.jchromb.2019.121731. Epub 2019 Jul 24.