treatments-xml/data/03/D3/87/03D387DCFFABFFC7CF0A8CAD473BCAF7.xml

<document id="046C47E496DFB21D93DA05B42AC84283" ID-CLB-Dataset="264534" ID-DOI="10.1016/j.phytochem.2020.112598" ID-GBIF-Dataset="c3ebb44c-c81a-4b58-9d60-13c793e6db2b" ID-ISSN="1873-3700" ID-Zenodo-Dep="8291902" IM.bibliography_approvedBy="felipe" IM.illustrations_approvedBy="juliana" IM.materialsCitations_approvedBy="felipe" IM.metadata_approvedBy="felipe" IM.tables_approvedBy="juliana" IM.taxonomicNames_approvedBy="guilherme" IM.treatments_approvedBy="juliana" checkinTime="1693247058183" checkinUser="felipe" docAuthor="Eliwa, Duaa, Albadry, Mohamed A., Ibrahim, Abdel-Rahim S., Kabbash, Amal, Meepagala, Kumudini, Khan, Ikhlas A., El-Aasr, Mona &amp; Ross, Samir A." docDate="2021" docId="03D387DCFFABFFC7CF0A8CAD473BCAF7" docLanguage="en" docName="Phytochemistry.183.112598.pdf" docOrigin="Phytochemistry (112598) 183" docSource="http://dx.doi.org/10.1016/j.phytochem.2020.112598" docStyle="DocumentStyle:F36D69FC8B198FBE91029DF9C24697D3.6:Phytochemistry.2020-.journal_article" docStyleId="F36D69FC8B198FBE91029DF9C24697D3" docStyleName="Phytochemistry.2020-.journal_article" docStyleVersion="6" docTitle="Aspergillus niger NRRL" docType="treatment" docVersion="6" lastPageNumber="7" masterDocId="FFEAFFA4FFAEFFC1CC388A394439CD4C" masterDocTitle="Biotransformation of papaverine and in silico docking studies of the metabolites on human phosphodiesterase 10 a" masterLastPageNumber="12" masterPageNumber="1" pageNumber="6" updateTime="1735847941220" updateUser="guilherme">
<mods:mods id="FB14D233219633F98591826BF337FFAB" xmlns:mods="http://www.loc.gov/mods/v3">
<mods:titleInfo id="B97051DC116914D939FA5293294BD000">
<mods:title id="F6F9A9CE7B89D9749FA1621A9E558359">Biotransformation of papaverine and in silico docking studies of the metabolites on human phosphodiesterase 10 a</mods:title>
</mods:titleInfo>
<mods:name id="CB01A3B528834218816CD91C32453570" type="personal">
<mods:role id="7A0404D1719D5A7C7C9BED78ED47C808">
<mods:roleTerm id="3F182645DF0ED6C21E666DFB1836B440">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="DA196E1CA64F12D71FCBC9714E853F2D">Eliwa, Duaa</mods:namePart>
<mods:affiliation id="1B715422D7CE3F54558DA32CCAF8F478">* &amp; National Center for Natural Products Research, School of Pharmacy, The University of Mississippi, MS, 38677, USA &amp; Department of Pharmacognosy, Faculty of Pharmacy, Tanta University, Tanta, 31527, Egypt</mods:affiliation>
</mods:name>
<mods:name id="12C934C7F185D033DAC9D20C3AE926F2" type="personal">
<mods:role id="3A0773A2FA34B2FBB4A49A0F75D97C64">
<mods:roleTerm id="F242565E3F412B2FADEF0BF791913712">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="ECB190114D85752C71C9B98FED1504A1">Albadry, Mohamed A.</mods:namePart>
<mods:affiliation id="A5C0AC52C37A78BDFC99588DF7289762">* &amp; National Center for Natural Products Research, School of Pharmacy, The University of Mississippi, MS, 38677, USA</mods:affiliation>
</mods:name>
<mods:name id="ECB0689529A3E60D52F2813EA72E3445" type="personal">
<mods:role id="8E8D9193141610CF0E27714CD995ACD6">
<mods:roleTerm id="9F5129CE6E7DBEADB6B69E6C032DF219">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="887C7572FA0BE76414C4EFBFF9098A2B">Ibrahim, Abdel-Rahim S.</mods:namePart>
<mods:affiliation id="F8880727B31F161C9754A825DCC8B7E9">Department of Pharmacognosy, Faculty of Pharmacy, Tanta University, Tanta, 31527, Egypt</mods:affiliation>
</mods:name>
<mods:name id="0AEA109F0AA3B4E0B2F166E09777111C" type="personal">
<mods:role id="849808D79D660C49A0FD2731AF6194DF">
<mods:roleTerm id="CD43317159E62ABA38D3D2E9AF6C1131">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="61B7A39BD36137C1B46ACEFCC8F8CC01">Kabbash, Amal</mods:namePart>
<mods:affiliation id="D80F5454D721F1811244E49DD34BF11B">Department of Pharmacognosy, Faculty of Pharmacy, Tanta University, Tanta, 31527, Egypt</mods:affiliation>
</mods:name>
<mods:name id="32BBEF22374833356EAB0C794DFA3BB6" type="personal">
<mods:role id="2B7A7D6F249E6D301EADED0395F0AFA8">
<mods:roleTerm id="53C9902F5F23E7E38F434FFA0EEFFB64">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="646B0881FB6E84DCEB9E6E949DB44950">Meepagala, Kumudini</mods:namePart>
<mods:affiliation id="DA0AAB6B790B71C25583B6F57116DC24">USDA-ARS, Natural Products Utilization Research Unit, University, MS, USA</mods:affiliation>
</mods:name>
<mods:name id="091763EB6C6BEAB10B2D98E0C2D4CF4A" type="personal">
<mods:role id="276275EE0D1BBA922E2BFAC5EADDB984">
<mods:roleTerm id="661AEBF68F4EA144FF1A33A4DA44BD40">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="1B28387C4DF628B54A4EC959D542C767">Khan, Ikhlas A.</mods:namePart>
<mods:affiliation id="25155B4A70F0BB3D71B3BE560DDA5A92">* &amp; National Center for Natural Products Research, School of Pharmacy, The University of Mississippi, MS, 38677, USA &amp; * &amp; Division of Pharmacognosy, Department of Biomolecular Sciences, School of Pharmacy, University of Mississippi, MS, 38677, USA</mods:affiliation>
</mods:name>
<mods:name id="28EDDA74E900FEE0F87EECDB931549EC" type="personal">
<mods:role id="05D3859551AE924CB581C926E2E5342D">
<mods:roleTerm id="DE384977873049A3D932E7464F1F6474">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="62E7516984F5F280C4B5CC6C5026FBF6">El-Aasr, Mona</mods:namePart>
<mods:affiliation id="A05252BD6F8C77BD477EE6F8D22DECB8">Department of Pharmacognosy, Faculty of Pharmacy, Tanta University, Tanta, 31527, Egypt</mods:affiliation>
</mods:name>
<mods:name id="6ADD265382E8F6E2395B039684305ACF" type="personal">
<mods:role id="AB10C322FC45FA4C8F00392F32036EEF">
<mods:roleTerm id="36E5441DFD339471F752107E3D248224">Author</mods:roleTerm>
</mods:role>
<mods:namePart id="99A4E2EAD37C89CEC81F9F845A26D011">Ross, Samir A.</mods:namePart>
<mods:affiliation id="2802B84A07FF106981026C3DD2DA8A15">* &amp; National Center for Natural Products Research, School of Pharmacy, The University of Mississippi, MS, 38677, USA &amp; * &amp; Division of Pharmacognosy, Department of Biomolecular Sciences, School of Pharmacy, University of Mississippi, MS, 38677, USA</mods:affiliation>
</mods:name>
<mods:typeOfResource id="026DA22E14A6ECF373852D4BAF9C3B23">text</mods:typeOfResource>
<mods:relatedItem id="33C3E6C5A80CDEE72FE2EA6C5467E935" type="host">
<mods:titleInfo id="EED50B0EEB955E492DDF91FB508546A4">
<mods:title id="097CDAC056E9A6D4C9B2D3DC5A0E92D7">Phytochemistry</mods:title>
</mods:titleInfo>
<mods:part id="3824CE833A2AEDB714E2F578B0947F00">
<mods:date id="3902D4CF4E5668352B8A5DC16C8E88F0">2021</mods:date>
<mods:detail id="126800F849A37ACEB693CB59937BC322" type="series">
<mods:title id="C3EECB30ABCA01BE039E825322D5EE93">112598</mods:title>
</mods:detail>
<mods:detail id="4E535B89B49324F0A3D54227A62D2012" type="pubDate">
<mods:number id="C260D147BD1792C5D2D07FDF5721E7FB">2021-03-31</mods:number>
</mods:detail>
<mods:detail id="1B2496FEFA7D4E44FF3B3383380818B0" type="volume">
<mods:number id="044F9B55073A7685AF01834F1474D52A">183</mods:number>
</mods:detail>
<mods:extent id="5194B5746E0F8E87A115BA4AD4E9867A" unit="page">
<mods:start id="D84D935BD849D5B27F2743281D79B41D">1</mods:start>
<mods:end id="90C34FC26F0732ADA9D4D3ADC118806B">12</mods:end>
</mods:extent>
</mods:part>
</mods:relatedItem>
<mods:location id="60E1343575860B65AA2C8FF32DCCB795">
<mods:url id="B62E3B8920B726529B9CB0389828F4ED">http://dx.doi.org/10.1016/j.phytochem.2020.112598</mods:url>
</mods:location>
<mods:classification id="21589FE9369B5A5E71871F28569F5F72">journal article</mods:classification>
<mods:identifier id="79A61F010E326406542C99CD8FA9E3DD" type="CLB-Dataset">264534</mods:identifier>
<mods:identifier id="AB21A6281EF2AF9170A1158017C59FA2" type="DOI">10.1016/j.phytochem.2020.112598</mods:identifier>
<mods:identifier id="364AC7706D16496B7FFD939A1ECD65A8" type="GBIF-Dataset">c3ebb44c-c81a-4b58-9d60-13c793e6db2b</mods:identifier>
<mods:identifier id="94A8B007C6366F12F9FB15C1162BE2A8" type="ISSN">1873-3700</mods:identifier>
<mods:identifier id="2988575DF0006C1F5FAF18FC0BE9EC77" type="Zenodo-Dep">8291902</mods:identifier>
</mods:mods>
<treatment id="03D387DCFFABFFC7CF0A8CAD473BCAF7" ID-DOI="http://doi.org/10.5281/zenodo.8302180" ID-GBIF-Taxon="212651918" ID-Zenodo-Dep="8302180" LSID="urn:lsid:plazi:treatment:03D387DCFFABFFC7CF0A8CAD473BCAF7" httpUri="http://treatment.plazi.org/id/03D387DCFFABFFC7CF0A8CAD473BCAF7" lastPageId="6" lastPageNumber="7" pageId="5" pageNumber="6">
<subSubSection id="C3606541FFABFFC4CF0A8CAD414FCBEB" box="[818,1398,1683,1703]" pageId="5" pageNumber="6" type="nomenclature">
<paragraph id="8BC536CAFFABFFC4CF0A8CAD414FCBEB" blockId="5.[818,1398,1683,1703]" box="[818,1398,1683,1703]" pageId="5" pageNumber="6">
<emphasis id="B90EEAD8FFABFFC4CF0A8CAD414FCBEB" bold="true" box="[818,1398,1683,1703]" italics="true" pageId="5" pageNumber="6">
3.5. Microbial transformation using 
<taxonomicName id="4C7A4D49FFABFFC4C8458CAA4136CBEB" ID-CoL="HC7Z" authority="NRRL" authorityName="NRRL" box="[1149,1295,1683,1703]" class="Eurotiomycetes" family="Aspergillaceae" genus="Aspergillus" higherTaxonomySource="CoL" kingdom="Fungi" order="Eurotiales" pageId="5" pageNumber="6" phylum="Ascomycota" rank="species" species="niger">Aspergillus niger</taxonomicName>
NRRL 322
</emphasis>
</paragraph>
</subSubSection>
<subSubSection id="C3606541FFABFFC7CF698CF2473BCAF7" lastPageId="6" lastPageNumber="7" pageId="5" pageNumber="6" type="description">
<paragraph id="8BC536CAFFABFFC7CF698CF245F9CA58" blockId="5.[818,1488,1739,1982]" lastBlockId="6.[100,770,1793,1981]" lastPageId="6" lastPageNumber="7" pageId="5" pageNumber="6">
Biotransformation of papaverine using 
<taxonomicName id="4C7A4D49FFABFFC4C8F68CF2415BCB92" authority="NRRL" authorityName="NRRL" box="[1230,1378,1739,1758]" class="Eurotiomycetes" family="Aspergillaceae" genus="Aspergillus" higherTaxonomySource="CoL" kingdom="Fungi" order="Eurotiales" pageId="5" pageNumber="6" phylum="Ascomycota" rank="species" species="niger">
<emphasis id="B90EEAD8FFABFFC4C8F68CF2415BCB92" bold="true" box="[1230,1378,1739,1758]" italics="true" pageId="5" pageNumber="6">Aspergillus niger</emphasis>
</taxonomicName>
NRRL 322 afforded to two metabolites (2 and 3). The residue (1 gm) was dissolved in 50 ml of methanol/dichloromethane mixture (1:1) and adsorbed onto 1 gm Celite and dried. The adsorbed sample was placed onto a glass column (50 × 
<quantity id="4C829B2FFFABFFC4CFF08D024036CA02" box="[968,1039,1851,1870]" metricMagnitude="-2" metricUnit="m" metricValue="2.5" pageId="5" pageNumber="6" unit="cm" value="2.5">2.5 cm</quantity>
) packed with silica after making a slurry in dichloromethane. The column was isocratically eluted with dichloromethane: methanol (97.5:2.5) and 10 ml fractions were collected. Fractions 20–44 were pooled together to give mixture of 
<emphasis id="B90EEAD8FFABFFC4C95D8DB64148CAEE" bold="true" box="[1381,1393,1935,1954]" pageId="5" pageNumber="6">2</emphasis>
and 
<emphasis id="B90EEAD8FFABFFC4C99E8DB6418BCAEE" bold="true" box="[1446,1458,1935,1954]" pageId="5" pageNumber="6">3</emphasis>
as determined by TLC. The metabolites were obtained in the form of yellowish residue (
<quantity id="4C829B2FFFA8FFC7CD2E8D38456CCA58" box="[278,341,1793,1812]" metricMagnitude="-5" metricUnit="kg" metricValue="8.0" pageId="6" pageNumber="7" unit="mg" value="80.0">80 mg</quantity>
, 
<emphasis id="B90EEAD8FFA8FFC7CD678D384554CA58" bold="true" box="[351,365,1793,1812]" italics="true" pageId="6" pageNumber="7">R</emphasis>
f 0.3 S 
<subScript id="17FE348FFFA8FFC7CD918D31458BCA5A" attach="left" box="[425,434,1800,1814]" fontSize="6" pageId="6" pageNumber="7">2</subScript>
).
</paragraph>
<caption id="DF056642FFABFFC4CC8A8D2B44FECAF5" ID-DOI="http://doi.org/10.5281/zenodo.8302178" ID-Zenodo-Dep="8302178" box="[178,199,1810,1977]" httpUri="https://zenodo.org/record/8302178/files/figure.png" pageId="5" pageNumber="6" startId="5.[178,199,1810,1817]" targetBox="[202,672,148,1977]" targetPageId="5">
<paragraph id="8BC536CAFFABFFC4CC8A8D2B44FECACD" blockId="5.[178,199,1810,1977]" box="[178,199,1810,1921]" pageId="5" pageNumber="6">
) 
<emphasis id="B90EEAD8FFABFFC4CC8A8D2544FECA26" bold="true" box="[178,199,1820,1898]" italics="true" pageId="5" pageNumber="6">continued</emphasis>
(
<emphasis id="B90EEAD8FFABFFC4CC8A8D4F44FECACD" bold="true" box="[178,199,1910,1921]" pageId="5" pageNumber="6">4</emphasis>
</paragraph>
<paragraph id="8BC536CAFFABFFC4CC8A8DBE44FECAF5" blockId="5.[178,199,1810,1977]" box="[178,199,1927,1977]" pageId="5" pageNumber="6">
<emphasis id="B90EEAD8FFABFFC4CC8A8DBE44FECAF5" bold="true" box="[178,199,1927,1977]" pageId="5" pageNumber="6">Table</emphasis>
</paragraph>
</caption>
<caption id="DF056642FFA8FFC7CC5C889445ECCFBD" ID-DOI="http://doi.org/10.5281/zenodo.8291906" ID-Zenodo-Dep="8291906" httpUri="https://zenodo.org/record/8291906/files/figure.png" pageId="6" pageNumber="7" startId="6.[100,130,685,702]" targetBox="[340,1248,149,657]" targetPageId="6" targetType="figure">
<paragraph id="8BC536CAFFA8FFC7CC5C889445ECCFBD" blockId="6.[100,1487,685,753]" pageId="6" pageNumber="7">
<emphasis id="B90EEAD8FFA8FFC7CC5C889444A6CFF2" bold="true" box="[100,159,685,702]" pageId="6" pageNumber="7">Fig. 2.</emphasis>
Docked poses of the five papaverine-based biotransformation products with better docking scores than the native ligand in the Human PDE-10 A crystal structure, PDB: 2WEY; 4 (red), 1 (yellow), 6 (blue), 3 (blum), 5 (faded orange). (For interpretation of the references to colour in this figure legend, the reader is referred to the Web version of this article.)
</paragraph>
</caption>
<caption id="DF056642FFA8FFC7CDDF8CFE4077CB94" ID-DOI="http://doi.org/10.5281/zenodo.8291908" ID-Zenodo-Dep="8291908" box="[487,1102,1735,1752]" httpUri="https://zenodo.org/record/8291908/files/figure.png" pageId="6" pageNumber="7" startId="6.[487,517,1735,1752]" targetBox="[226,1361,802,1706]" targetPageId="6" targetType="figure">
<paragraph id="8BC536CAFFA8FFC7CDDF8CFE4077CB94" blockId="6.[487,1102,1735,1752]" box="[487,1102,1735,1752]" pageId="6" pageNumber="7">
<emphasis id="B90EEAD8FFA8FFC7CDDF8CFE4619CB94" bold="true" box="[487,544,1735,1752]" pageId="6" pageNumber="7">Fig. 3.</emphasis>
Structure of papaverine and its metabolite from different Fungi.
</paragraph>
</caption>
<paragraph id="8BC536CAFFA8FFC7CCBC8D24473BCAF7" blockId="6.[100,770,1793,1981]" pageId="6" pageNumber="7">
The mixture was loaded in silica biotage column (18 × 
<quantity id="4C829B2FFFA8FFC7CE478D2446E9CA7C" box="[639,720,1821,1840]" metricMagnitude="-1" metricUnit="m" metricValue="1.5" pageId="6" pageNumber="7" unit="mm" value="150.0">150 mm</quantity>
). The column was gradiently eluted with dichloromethane 100% then dichloromethane:2-propanol (98:2, 97:3,95:5) and 20 ml fractions were collected. Fractions 27–31 were pooled together to give pure 
<emphasis id="B90EEAD8FFA8FFC7CE898D494684CACF" bold="true" box="[689,701,1904,1923]" pageId="6" pageNumber="7">2</emphasis>
, in the form of white powder (
<quantity id="4C829B2FFFA8FFC7CD798DB5454DCAEC" box="[321,372,1932,1952]" metricMagnitude="-6" metricUnit="kg" metricValue="7.0" pageId="6" pageNumber="7" unit="mg" value="7.0">7 mg</quantity>
, 
<emphasis id="B90EEAD8FFA8FFC7CD468DB545A9CAED" bold="true" box="[382,400,1932,1953]" italics="true" pageId="6" pageNumber="7">
<subScript id="17FE348FFFA8FFC7CD468DB545A9CAED" attach="left" box="[382,400,1932,1953]" fontSize="6" pageId="6" pageNumber="7">Rf</subScript>
</emphasis>
0.70 S 
<subScript id="17FE348FFFA8FFC7CDEB8DAD45E5CAEE" attach="right" box="[467,476,1940,1954]" fontSize="6" pageId="6" pageNumber="7">1</subScript>
). Fractions 65–85 were pooled together to give pure 
<emphasis id="B90EEAD8FFA8FFC7CD138D91450ECAF7" bold="true" box="[299,311,1960,1979]" pageId="6" pageNumber="7">3</emphasis>
, in the form of white powder (
<quantity id="4C829B2FFFA8FFC7CE6A8D9146A9CAF0" box="[594,656,1960,1980]" metricMagnitude="-5" metricUnit="kg" metricValue="3.0" pageId="6" pageNumber="7" unit="mg" value="30.0">30 mg</quantity>
, 
<emphasis id="B90EEAD8FFA8FFC7CEA08D91469FCAF7" bold="true" box="[664,678,1960,1979]" italics="true" pageId="6" pageNumber="7">R</emphasis>
f 0.61 S 
<subScript id="17FE348FFFA8FFC7CED38D9646CDCAF1" attach="left" box="[747,756,1967,1981]" fontSize="6" pageId="6" pageNumber="7">1</subScript>
).
</paragraph>
</subSubSection>
</treatment>
</document>