Ultra-high-performance liquid chromatography charge transfer dissociation mass spectrometry (UHPLC-CTD-MS) as a tool for analyzing the structural heterogeneity in carrageenan oligosaccharides
Ultra-high-performance liquid chromatography (UHPLC) with charge transfer dissociation mass spectrometry (CTD-MS) is presented for the analysis of a mixture of complex sulfated oligosaccharides. The mixture contained kappa ( κ ), iota ( ι ), and lambda ( λ ) carrageenans that contain anhydro bridges...
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| Veröffentlicht in: | Analytical and bioanalytical chemistry 2022-01, Vol.414 (1), p.303-318 |
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| creator | Mendis, Praneeth M. Sasiene, Zachary J. Ropartz, David Rogniaux, Hélène Jackson, Glen P. |
| description | Ultra-high-performance liquid chromatography (UHPLC) with charge transfer dissociation mass spectrometry (CTD-MS) is presented for the analysis of a mixture of complex sulfated oligosaccharides. The mixture contained kappa (
κ
), iota (
ι
), and lambda (
λ
) carrageenans that contain anhydro bridges, different degrees of sulfation ranging from one to three per dimer, different positioning of the sulfate groups along the backbone, and varying degrees of polymerization (DP) between 4 and 12. Optimization studies using standard mixtures of carrageenans helped establish the optimal conditions for online UHPLC-CTD-MS/MS analysis. Optimization included (1) UHPLC conditions; (2) ion source conditions, such as the capillary voltage, drying gas and nebulizing gas temperature, and flow rate; and (3) CTD-MS conditions, including data-dependent CTD-MS. The UHPLC-CTD results were contrasted with UHPLC-CID results of the same mixture on the same instrument. Whereas CID tends to produce B/Y and C/Z ions with many neutral losses, CTD produced more abundant A/X ions and less abundant neutral losses, which enabled more confident structural detail. The results demonstrate that He-CTD is compatible with the timescale of UHPLC and provides more structural information about carrageenans compared to state-of-the-art methods like UHPLC-CID analysis. |
| doi_str_mv | 10.1007/s00216-021-03396-3 |
| format | Article |
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κ
), iota (
ι
), and lambda (
λ
) carrageenans that contain anhydro bridges, different degrees of sulfation ranging from one to three per dimer, different positioning of the sulfate groups along the backbone, and varying degrees of polymerization (DP) between 4 and 12. Optimization studies using standard mixtures of carrageenans helped establish the optimal conditions for online UHPLC-CTD-MS/MS analysis. Optimization included (1) UHPLC conditions; (2) ion source conditions, such as the capillary voltage, drying gas and nebulizing gas temperature, and flow rate; and (3) CTD-MS conditions, including data-dependent CTD-MS. The UHPLC-CTD results were contrasted with UHPLC-CID results of the same mixture on the same instrument. Whereas CID tends to produce B/Y and C/Z ions with many neutral losses, CTD produced more abundant A/X ions and less abundant neutral losses, which enabled more confident structural detail. The results demonstrate that He-CTD is compatible with the timescale of UHPLC and provides more structural information about carrageenans compared to state-of-the-art methods like UHPLC-CID analysis.</description><identifier>ISSN: 1618-2642</identifier><identifier>EISSN: 1618-2650</identifier><identifier>DOI: 10.1007/s00216-021-03396-3</identifier><identifier>PMID: 34050776</identifier><language>eng</language><publisher>Berlin/Heidelberg: Springer Berlin Heidelberg</publisher><subject>ABCs 20th Anniversary ; Analysis ; Analytical Chemistry ; Biochemistry ; Carbohydrate Conformation ; Carrageenan ; Carrageenan - chemistry ; Carrageenans ; Carrageenin ; Characterization and Evaluation of Materials ; Charge transfer ; Chemical Sciences ; Chemistry ; Chemistry and Materials Science ; Chromatography ; Chromatography, High Pressure Liquid - methods ; Dimers ; Drying ; Flow rates ; Flow velocity ; Food Science ; Gas temperature ; Heterogeneity ; High performance liquid chromatography ; Ion sources ; Ions ; Laboratory Medicine ; Liquid chromatography ; Mass spectrometry ; Mass Spectrometry - methods ; Mass spectroscopy ; Methods ; Monitoring/Environmental Analysis ; Oligosaccharides ; Oligosaccharides - chemistry ; Optimization ; Paper in Forefront ; Rhodophyta - chemistry ; Scientific imaging ; Spectroscopy ; Sulfation</subject><ispartof>Analytical and bioanalytical chemistry, 2022-01, Vol.414 (1), p.303-318</ispartof><rights>Springer-Verlag GmbH Germany, part of Springer Nature 2021</rights><rights>2021. Springer-Verlag GmbH Germany, part of Springer Nature.</rights><rights>COPYRIGHT 2022 Springer</rights><rights>Springer-Verlag GmbH Germany, part of Springer Nature 2021.</rights><rights>Distributed under a Creative Commons Attribution 4.0 International License</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c448t-ff30dfea400dfd8e672e313201cb9e4a758a2f84c6df09380781c2401bc3d8c03</citedby><cites>FETCH-LOGICAL-c448t-ff30dfea400dfd8e672e313201cb9e4a758a2f84c6df09380781c2401bc3d8c03</cites><orcidid>0000-0001-6083-2034 ; 0000-0003-4767-6940</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://link.springer.com/content/pdf/10.1007/s00216-021-03396-3$$EPDF$$P50$$Gspringer$$H</linktopdf><linktohtml>$$Uhttps://link.springer.com/10.1007/s00216-021-03396-3$$EHTML$$P50$$Gspringer$$H</linktohtml><link.rule.ids>230,314,780,784,885,27923,27924,41487,42556,51318</link.rule.ids><backlink>$$Uhttps://www.ncbi.nlm.nih.gov/pubmed/34050776$$D View this record in MEDLINE/PubMed$$Hfree_for_read</backlink><backlink>$$Uhttps://hal.inrae.fr/hal-03318863$$DView record in HAL$$Hfree_for_read</backlink></links><search><creatorcontrib>Mendis, Praneeth M.</creatorcontrib><creatorcontrib>Sasiene, Zachary J.</creatorcontrib><creatorcontrib>Ropartz, David</creatorcontrib><creatorcontrib>Rogniaux, Hélène</creatorcontrib><creatorcontrib>Jackson, Glen P.</creatorcontrib><title>Ultra-high-performance liquid chromatography charge transfer dissociation mass spectrometry (UHPLC-CTD-MS) as a tool for analyzing the structural heterogeneity in carrageenan oligosaccharides</title><title>Analytical and bioanalytical chemistry</title><addtitle>Anal Bioanal Chem</addtitle><addtitle>Anal Bioanal Chem</addtitle><description>Ultra-high-performance liquid chromatography (UHPLC) with charge transfer dissociation mass spectrometry (CTD-MS) is presented for the analysis of a mixture of complex sulfated oligosaccharides. The mixture contained kappa (
κ
), iota (
ι
), and lambda (
λ
) carrageenans that contain anhydro bridges, different degrees of sulfation ranging from one to three per dimer, different positioning of the sulfate groups along the backbone, and varying degrees of polymerization (DP) between 4 and 12. Optimization studies using standard mixtures of carrageenans helped establish the optimal conditions for online UHPLC-CTD-MS/MS analysis. Optimization included (1) UHPLC conditions; (2) ion source conditions, such as the capillary voltage, drying gas and nebulizing gas temperature, and flow rate; and (3) CTD-MS conditions, including data-dependent CTD-MS. The UHPLC-CTD results were contrasted with UHPLC-CID results of the same mixture on the same instrument. Whereas CID tends to produce B/Y and C/Z ions with many neutral losses, CTD produced more abundant A/X ions and less abundant neutral losses, which enabled more confident structural detail. The results demonstrate that He-CTD is compatible with the timescale of UHPLC and provides more structural information about carrageenans compared to state-of-the-art methods like UHPLC-CID analysis.</description><subject>ABCs 20th Anniversary</subject><subject>Analysis</subject><subject>Analytical Chemistry</subject><subject>Biochemistry</subject><subject>Carbohydrate Conformation</subject><subject>Carrageenan</subject><subject>Carrageenan - chemistry</subject><subject>Carrageenans</subject><subject>Carrageenin</subject><subject>Characterization and Evaluation of Materials</subject><subject>Charge transfer</subject><subject>Chemical Sciences</subject><subject>Chemistry</subject><subject>Chemistry and Materials Science</subject><subject>Chromatography</subject><subject>Chromatography, High Pressure Liquid - methods</subject><subject>Dimers</subject><subject>Drying</subject><subject>Flow rates</subject><subject>Flow velocity</subject><subject>Food Science</subject><subject>Gas temperature</subject><subject>Heterogeneity</subject><subject>High performance liquid chromatography</subject><subject>Ion sources</subject><subject>Ions</subject><subject>Laboratory Medicine</subject><subject>Liquid chromatography</subject><subject>Mass spectrometry</subject><subject>Mass Spectrometry - methods</subject><subject>Mass spectroscopy</subject><subject>Methods</subject><subject>Monitoring/Environmental Analysis</subject><subject>Oligosaccharides</subject><subject>Oligosaccharides - chemistry</subject><subject>Optimization</subject><subject>Paper in Forefront</subject><subject>Rhodophyta - chemistry</subject><subject>Scientific imaging</subject><subject>Spectroscopy</subject><subject>Sulfation</subject><issn>1618-2642</issn><issn>1618-2650</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2022</creationdate><recordtype>article</recordtype><sourceid>EIF</sourceid><sourceid>ABUWG</sourceid><sourceid>AFKRA</sourceid><sourceid>AZQEC</sourceid><sourceid>BENPR</sourceid><sourceid>CCPQU</sourceid><sourceid>DWQXO</sourceid><sourceid>GNUQQ</sourceid><recordid>eNp9ks1u1DAQxyMEoqXwAhyQJS7tIcWO8-E9rpaPRVoEEt2zNetMEleOvbWdSsvL8Wp4m3aROCBLM_b49x-PPJNlbxm9ZpQ2HwKlBavzZHLK-aLO-bPsnNVM5EVd0eenfVmcZa9CuKWUVYLVL7MzXtKKNk19nv3emughH3Q_5Hv0nfMjWIXE6LtJt0QN3o0QXe9hPxzSEXyPJCls6NCTVofglIaonSUjhEDCHlVMGoz-QC636x-bVb66-Zh_-3lFIBAg0TlD0jMELJjDL217EgckIfpJxcmDIQNG9K5HizoeiLZEgffQI1qwxBnduwDqWIluMbzOXnRgAr559BfZ9vOnm9U633z_8nW13OSqLEXMu47TtkMoaXKtwLopkDNeUKZ2CyyhqQQUnShV3XZ0wQVtBFNFSdlO8VYoyi-yqznvAEbuvR7BH6QDLdfLjTzGUgeYEDW_Z4m9nNm9d3cThihHHRQaAxbdFGRR8bJmjDVH9P0_6K2bfPqZRKXmcVE0iypR1zPVg0GpbedSB1RaLY5aOYudTvFlLRZFVZXVUVDMAuVdCB67U8mMyuPsyHl2ZDLyYXYkT6J3j7VMuxHbk-RpWBLAZyCkK9uj_1vsf9L-ATpz0dg</recordid><startdate>20220101</startdate><enddate>20220101</enddate><creator>Mendis, Praneeth M.</creator><creator>Sasiene, Zachary J.</creator><creator>Ropartz, David</creator><creator>Rogniaux, Hélène</creator><creator>Jackson, Glen P.</creator><general>Springer Berlin Heidelberg</general><general>Springer</general><general>Springer Nature B.V</general><general>Springer Verlag</general><scope>CGR</scope><scope>CUY</scope><scope>CVF</scope><scope>ECM</scope><scope>EIF</scope><scope>NPM</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>3V.</scope><scope>7QF</scope><scope>7QO</scope><scope>7QQ</scope><scope>7SC</scope><scope>7SE</scope><scope>7SP</scope><scope>7SR</scope><scope>7TA</scope><scope>7TB</scope><scope>7U5</scope><scope>7U7</scope><scope>7X7</scope><scope>7XB</scope><scope>88E</scope><scope>8BQ</scope><scope>8FD</scope><scope>8FE</scope><scope>8FG</scope><scope>8FH</scope><scope>8FI</scope><scope>8FJ</scope><scope>8FK</scope><scope>ABJCF</scope><scope>ABUWG</scope><scope>AEUYN</scope><scope>AFKRA</scope><scope>AZQEC</scope><scope>BBNVY</scope><scope>BENPR</scope><scope>BGLVJ</scope><scope>BHPHI</scope><scope>C1K</scope><scope>CCPQU</scope><scope>D1I</scope><scope>DWQXO</scope><scope>F28</scope><scope>FR3</scope><scope>FYUFA</scope><scope>GHDGH</scope><scope>GNUQQ</scope><scope>H8D</scope><scope>H8G</scope><scope>HCIFZ</scope><scope>JG9</scope><scope>JQ2</scope><scope>K9.</scope><scope>KB.</scope><scope>KR7</scope><scope>L7M</scope><scope>LK8</scope><scope>L~C</scope><scope>L~D</scope><scope>M0S</scope><scope>M1P</scope><scope>M7P</scope><scope>P64</scope><scope>PDBOC</scope><scope>PQEST</scope><scope>PQQKQ</scope><scope>PQUKI</scope><scope>7X8</scope><scope>1XC</scope><orcidid>https://orcid.org/0000-0001-6083-2034</orcidid><orcidid>https://orcid.org/0000-0003-4767-6940</orcidid></search><sort><creationdate>20220101</creationdate><title>Ultra-high-performance liquid chromatography charge transfer dissociation mass spectrometry (UHPLC-CTD-MS) as a tool for analyzing the structural heterogeneity in carrageenan oligosaccharides</title><author>Mendis, Praneeth M. ; Sasiene, Zachary J. ; Ropartz, David ; Rogniaux, Hélène ; Jackson, Glen P.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c448t-ff30dfea400dfd8e672e313201cb9e4a758a2f84c6df09380781c2401bc3d8c03</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2022</creationdate><topic>ABCs 20th Anniversary</topic><topic>Analysis</topic><topic>Analytical Chemistry</topic><topic>Biochemistry</topic><topic>Carbohydrate Conformation</topic><topic>Carrageenan</topic><topic>Carrageenan - chemistry</topic><topic>Carrageenans</topic><topic>Carrageenin</topic><topic>Characterization and Evaluation of Materials</topic><topic>Charge transfer</topic><topic>Chemical Sciences</topic><topic>Chemistry</topic><topic>Chemistry and Materials Science</topic><topic>Chromatography</topic><topic>Chromatography, High Pressure Liquid - methods</topic><topic>Dimers</topic><topic>Drying</topic><topic>Flow rates</topic><topic>Flow velocity</topic><topic>Food Science</topic><topic>Gas temperature</topic><topic>Heterogeneity</topic><topic>High performance liquid chromatography</topic><topic>Ion sources</topic><topic>Ions</topic><topic>Laboratory Medicine</topic><topic>Liquid chromatography</topic><topic>Mass spectrometry</topic><topic>Mass Spectrometry - methods</topic><topic>Mass spectroscopy</topic><topic>Methods</topic><topic>Monitoring/Environmental Analysis</topic><topic>Oligosaccharides</topic><topic>Oligosaccharides - chemistry</topic><topic>Optimization</topic><topic>Paper in Forefront</topic><topic>Rhodophyta - 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Academic</collection><collection>Hyper Article en Ligne (HAL)</collection><jtitle>Analytical and bioanalytical chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Mendis, Praneeth M.</au><au>Sasiene, Zachary J.</au><au>Ropartz, David</au><au>Rogniaux, Hélène</au><au>Jackson, Glen P.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Ultra-high-performance liquid chromatography charge transfer dissociation mass spectrometry (UHPLC-CTD-MS) as a tool for analyzing the structural heterogeneity in carrageenan oligosaccharides</atitle><jtitle>Analytical and bioanalytical chemistry</jtitle><stitle>Anal Bioanal Chem</stitle><addtitle>Anal Bioanal Chem</addtitle><date>2022-01-01</date><risdate>2022</risdate><volume>414</volume><issue>1</issue><spage>303</spage><epage>318</epage><pages>303-318</pages><issn>1618-2642</issn><eissn>1618-2650</eissn><abstract>Ultra-high-performance liquid chromatography (UHPLC) with charge transfer dissociation mass spectrometry (CTD-MS) is presented for the analysis of a mixture of complex sulfated oligosaccharides. The mixture contained kappa (
κ
), iota (
ι
), and lambda (
λ
) carrageenans that contain anhydro bridges, different degrees of sulfation ranging from one to three per dimer, different positioning of the sulfate groups along the backbone, and varying degrees of polymerization (DP) between 4 and 12. Optimization studies using standard mixtures of carrageenans helped establish the optimal conditions for online UHPLC-CTD-MS/MS analysis. Optimization included (1) UHPLC conditions; (2) ion source conditions, such as the capillary voltage, drying gas and nebulizing gas temperature, and flow rate; and (3) CTD-MS conditions, including data-dependent CTD-MS. The UHPLC-CTD results were contrasted with UHPLC-CID results of the same mixture on the same instrument. Whereas CID tends to produce B/Y and C/Z ions with many neutral losses, CTD produced more abundant A/X ions and less abundant neutral losses, which enabled more confident structural detail. The results demonstrate that He-CTD is compatible with the timescale of UHPLC and provides more structural information about carrageenans compared to state-of-the-art methods like UHPLC-CID analysis.</abstract><cop>Berlin/Heidelberg</cop><pub>Springer Berlin Heidelberg</pub><pmid>34050776</pmid><doi>10.1007/s00216-021-03396-3</doi><tpages>16</tpages><orcidid>https://orcid.org/0000-0001-6083-2034</orcidid><orcidid>https://orcid.org/0000-0003-4767-6940</orcidid></addata></record> |
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| subjects | ABCs 20th Anniversary Analysis Analytical Chemistry Biochemistry Carbohydrate Conformation Carrageenan Carrageenan - chemistry Carrageenans Carrageenin Characterization and Evaluation of Materials Charge transfer Chemical Sciences Chemistry Chemistry and Materials Science Chromatography Chromatography, High Pressure Liquid - methods Dimers Drying Flow rates Flow velocity Food Science Gas temperature Heterogeneity High performance liquid chromatography Ion sources Ions Laboratory Medicine Liquid chromatography Mass spectrometry Mass Spectrometry - methods Mass spectroscopy Methods Monitoring/Environmental Analysis Oligosaccharides Oligosaccharides - chemistry Optimization Paper in Forefront Rhodophyta - chemistry Scientific imaging Spectroscopy Sulfation |
| title | Ultra-high-performance liquid chromatography charge transfer dissociation mass spectrometry (UHPLC-CTD-MS) as a tool for analyzing the structural heterogeneity in carrageenan oligosaccharides |
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