Dataset

Dexamethasone; LC-ESI-QTOF; MS2; 40 V

This MassBank record with Accession MSBNK-BAFG-CSL2311109909 contains the MS2 mass spectrum of Dexamethasone with the InChIkey UREBDLICKHMUKA-CXSFZGCWSA-N.

Chemical Information

InChI	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
SMILES	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C
InChI Key	UREBDLICKHMUKA-CXSFZGCWSA-N
Molecular Formula	C22H29FO5
Exact Mass	392.200 g/mol

Data and Resources

DexamethasoneHTML

Go to source

Related Molecule ⌄

(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311109909
Version
Author
Maintainer
Language
MetadataPublished	2023-11-10
Related Molecule	(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
DB01234	drugbank
DEX	rcsb_pdb
CHEMBL384467	chembl
3774	surechembl
5743	pubchem
DEX	pdbe
LMST02030339	lipidmaps
PD003027	probes_and_drugs
DEXMET	CCDC
1159	brenda
147690	brenda
152027	brenda
48978	brenda
48979	brenda
CHEBI:41879	chebi
7S5I7G3JQL	fdasrs
HMDB0015364	hmdb
DTXSID3020384	comptox
NCT00000563	clinicaltrials
NCT00000658	clinicaltrials
NCT00000689	clinicaltrials
NCT00000776	clinicaltrials
NCT00000801	clinicaltrials
NCT00001842	clinicaltrials
NCT00002471	clinicaltrials
NCT00002481	clinicaltrials
NCT00002494	clinicaltrials
NCT00002499	clinicaltrials
NCT00002514	clinicaltrials
NCT00002517	clinicaltrials
NCT00002531	clinicaltrials
NCT00002532	clinicaltrials
NCT00002548	clinicaltrials
NCT00002665	clinicaltrials
NCT00002676	clinicaltrials
NCT00002678	clinicaltrials
NCT00002689	clinicaltrials
NCT00002691	clinicaltrials
NCT00002700	clinicaltrials
NCT00002704	clinicaltrials
NCT00002716	clinicaltrials
NCT00002744	clinicaltrials
NCT00002785	clinicaltrials
NCT00002788	clinicaltrials
NCT00002798	clinicaltrials
NCT00002812	clinicaltrials
NCT00002816	clinicaltrials
NCT00002849	clinicaltrials
NCT00002865	clinicaltrials
NCT00002878	clinicaltrials
NCT00003007	clinicaltrials
NCT00003143	clinicaltrials
NCT00003213	clinicaltrials
NCT00003217	clinicaltrials
NCT00003278	clinicaltrials
NCT00003311	clinicaltrials
NCT00003397	clinicaltrials
NCT00003399	clinicaltrials
NCT00003401	clinicaltrials
NCT00003402	clinicaltrials
NCT00003416	clinicaltrials
NCT00003423	clinicaltrials
NCT00003437	clinicaltrials
NCT00003449	clinicaltrials
NCT00003493	clinicaltrials
NCT00003603	clinicaltrials
NCT00003639	clinicaltrials
NCT00003650	clinicaltrials
NCT00003663	clinicaltrials
NCT00003671	clinicaltrials
NCT00003728	clinicaltrials
NCT00003753	clinicaltrials
NCT00003783	clinicaltrials
NCT00004228	clinicaltrials
NCT00004778	clinicaltrials
NCT00004785	clinicaltrials
NCT00004990	clinicaltrials
NCT00005585	clinicaltrials
NCT00005596	clinicaltrials
NCT00005601	clinicaltrials
NCT00005603	clinicaltrials
NCT00005777	clinicaltrials
NCT00005834	clinicaltrials
NCT00005945	clinicaltrials
NCT00005977	clinicaltrials
NCT00005985	clinicaltrials
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NCT00016887	clinicaltrials
NCT00017069	clinicaltrials
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NCT00021359	clinicaltrials
NCT00022126	clinicaltrials
NCT00022737	clinicaltrials
NCT00024167	clinicaltrials
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NCT00026234	clinicaltrials
NCT00028886	clinicaltrials
NCT00030069	clinicaltrials
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NCT00038090	clinicaltrials
NCT00038610	clinicaltrials
NCT00039130	clinicaltrials
NCT00040937	clinicaltrials
NCT00041132	clinicaltrials
NCT00049374	clinicaltrials
NCT00050414	clinicaltrials
NCT00050440	clinicaltrials
NCT00054158	clinicaltrials
NCT00054522	clinicaltrials
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NCT00060398	clinicaltrials
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NCT00061945	clinicaltrials
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NCT00122278	clinicaltrials
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NCT00131261	clinicaltrials
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NCT00137111	clinicaltrials
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NCT00258245	clinicaltrials
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NCT00263484	clinicaltrials
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NCT00275015	clinicaltrials
NCT00275106	clinicaltrials
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NCT00276809	clinicaltrials
NCT00283985	clinicaltrials
NCT00285389	clinicaltrials
NCT00288080	clinicaltrials
NCT00290433	clinicaltrials
NCT00290498	clinicaltrials
NCT00290511	clinicaltrials
NCT00290823	clinicaltrials
NCT00292695	clinicaltrials
NCT00299182	clinicaltrials
NCT00302003	clinicaltrials
NCT00305812	clinicaltrials
NCT00308477	clinicaltrials
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NCT00308594	clinicaltrials
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NCT00316927	clinicaltrials
NCT00319865	clinicaltrials
NCT00324467	clinicaltrials
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NCT00333996	clinicaltrials
NCT00334672	clinicaltrials
NCT00335140	clinicaltrials
NCT00335348	clinicaltrials
NCT00335920	clinicaltrials
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NCT00343460	clinicaltrials
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NCT04751175	clinicaltrials
NCT04751877	clinicaltrials
NCT04752163	clinicaltrials
NCT04754945	clinicaltrials
NCT04756401	clinicaltrials
NCT04756726	clinicaltrials
NCT04762745	clinicaltrials
NCT04763434	clinicaltrials
NCT04764942	clinicaltrials
NCT04765371	clinicaltrials
NCT04766853	clinicaltrials
NCT04766996	clinicaltrials
NCT04775550	clinicaltrials
NCT04776395	clinicaltrials
NCT04776850	clinicaltrials
NCT04778267	clinicaltrials
NCT04780581	clinicaltrials
NCT04781335	clinicaltrials
NCT04782687	clinicaltrials
NCT04784559	clinicaltrials
NCT04786964	clinicaltrials
NCT04788654	clinicaltrials
NCT04790474	clinicaltrials
NCT04791345	clinicaltrials
NCT04791566	clinicaltrials
NCT04798391	clinicaltrials
NCT04799015	clinicaltrials
NCT04802356	clinicaltrials
NCT04812483	clinicaltrials
NCT04813653	clinicaltrials
NCT04816097	clinicaltrials
NCT04817189	clinicaltrials
NCT04817982	clinicaltrials
NCT04818372	clinicaltrials
NCT04818749	clinicaltrials
NCT04822337	clinicaltrials
NCT04826237	clinicaltrials
NCT04826822	clinicaltrials
NCT04828525	clinicaltrials
NCT04832880	clinicaltrials
NCT04834375	clinicaltrials
NCT04835129	clinicaltrials
NCT04836780	clinicaltrials
NCT04838652	clinicaltrials
NCT04839549	clinicaltrials
NCT04840615	clinicaltrials
NCT04843579	clinicaltrials
NCT04847453	clinicaltrials
NCT04848259	clinicaltrials
NCT04850885	clinicaltrials
NCT04853147	clinicaltrials
NCT04853147	clinicaltrials
NCT04853446	clinicaltrials
NCT04858776	clinicaltrials
NCT04860518	clinicaltrials
NCT04862468	clinicaltrials
NCT04862585	clinicaltrials
NCT04863742	clinicaltrials
NCT04875039	clinicaltrials
NCT04875039	clinicaltrials
NCT04877275	clinicaltrials
NCT04879823	clinicaltrials
NCT04882163	clinicaltrials
NCT04883242	clinicaltrials
NCT04889547	clinicaltrials
NCT04889781	clinicaltrials
NCT04890626	clinicaltrials
NCT04891289	clinicaltrials
NCT04891744	clinicaltrials
NCT04891809	clinicaltrials
NCT04892264	clinicaltrials
NCT04892420	clinicaltrials
NCT04892446	clinicaltrials
NCT04895410	clinicaltrials
NCT04895592	clinicaltrials
NCT04896658	clinicaltrials
NCT04899414	clinicaltrials
NCT04907227	clinicaltrials
NCT04908592	clinicaltrials
NCT04909918	clinicaltrials
NCT04910503	clinicaltrials
NCT04910568	clinicaltrials
NCT04911361	clinicaltrials
NCT04912271	clinicaltrials
NCT04912427	clinicaltrials
NCT04915248	clinicaltrials
NCT04917055	clinicaltrials
NCT04917250	clinicaltrials
NCT04919317	clinicaltrials
NCT04923893	clinicaltrials
NCT04924647	clinicaltrials
NCT04925193	clinicaltrials
NCT04933539	clinicaltrials
NCT04939142	clinicaltrials
NCT04939142	clinicaltrials
NCT04939844	clinicaltrials
NCT04940338	clinicaltrials
NCT04941937	clinicaltrials
NCT04945824	clinicaltrials
NCT04947189	clinicaltrials
NCT04956302	clinicaltrials
NCT04965155	clinicaltrials
NCT04970719	clinicaltrials
NCT04973605	clinicaltrials
NCT04975997	clinicaltrials
NCT04976777	clinicaltrials
NCT04977427	clinicaltrials
NCT04984330	clinicaltrials
NCT04989140	clinicaltrials
NCT04996160	clinicaltrials
NCT04998786	clinicaltrials
NCT04999878	clinicaltrials
NCT05000658	clinicaltrials
NCT05002361	clinicaltrials
NCT05004753	clinicaltrials
NCT05008367	clinicaltrials
NCT05016947	clinicaltrials
NCT05018091	clinicaltrials
NCT05020236	clinicaltrials
NCT05023304	clinicaltrials
NCT05023369	clinicaltrials
NCT05023915	clinicaltrials
NCT05027594	clinicaltrials
NCT05028348	clinicaltrials
NCT05032183	clinicaltrials
NCT05036577	clinicaltrials
NCT05048264	clinicaltrials
NCT05049473	clinicaltrials
NCT05050305	clinicaltrials
NCT05060627	clinicaltrials
NCT05062681	clinicaltrials
NCT05066997	clinicaltrials
NCT05070468	clinicaltrials
NCT05072262	clinicaltrials
NCT05083169	clinicaltrials
NCT05090566	clinicaltrials
NCT05096663	clinicaltrials
NCT05099471	clinicaltrials
NCT05100186	clinicaltrials
NCT05101928	clinicaltrials
NCT05105997	clinicaltrials
NCT05116345	clinicaltrials
NCT05120076	clinicaltrials
NCT05123131	clinicaltrials
NCT05124067	clinicaltrials
NCT05129085	clinicaltrials
NCT05132920	clinicaltrials
NCT05136560	clinicaltrials
NCT05137080	clinicaltrials
NCT05138029	clinicaltrials
NCT05139043	clinicaltrials
NCT05142098	clinicaltrials
NCT05143281	clinicaltrials
NCT05143762	clinicaltrials
NCT05145400	clinicaltrials
NCT05145543	clinicaltrials
NCT05147233	clinicaltrials
NCT05147493	clinicaltrials
NCT05158699	clinicaltrials
NCT05170789	clinicaltrials
NCT05180097	clinicaltrials
NCT05183139	clinicaltrials
NCT05186454	clinicaltrials
NCT05190705	clinicaltrials
NCT05191706	clinicaltrials
NCT05192889	clinicaltrials
NCT05195242	clinicaltrials
NCT05199311	clinicaltrials
NCT05205252	clinicaltrials
NCT05208307	clinicaltrials
NCT05232825	clinicaltrials
NCT05236621	clinicaltrials
NCT05242874	clinicaltrials
NCT05246631	clinicaltrials
NCT05248633	clinicaltrials
NCT05250973	clinicaltrials
NCT05257083	clinicaltrials
NCT05259839	clinicaltrials
NCT05271058	clinicaltrials
NCT05271539	clinicaltrials
NCT05272826	clinicaltrials
NCT05274113	clinicaltrials
NCT05280275	clinicaltrials
NCT05284409	clinicaltrials
NCT05285813	clinicaltrials
NCT05286814	clinicaltrials
NCT05287035	clinicaltrials
NCT05288062	clinicaltrials
NCT05289492	clinicaltrials
NCT05289908	clinicaltrials
NCT05292664	clinicaltrials
NCT05293210	clinicaltrials
NCT05293509	clinicaltrials
NCT05298683	clinicaltrials
NCT05302388	clinicaltrials
NCT05303311	clinicaltrials
NCT05303792	clinicaltrials
NCT05305404	clinicaltrials
NCT05306340	clinicaltrials
NCT05308654	clinicaltrials
NCT05316168	clinicaltrials
NCT05319730	clinicaltrials
NCT05325593	clinicaltrials
NCT05331690	clinicaltrials
NCT05334316	clinicaltrials
NCT05343156	clinicaltrials
NCT05346731	clinicaltrials
NCT05347381	clinicaltrials
NCT05359731	clinicaltrials
NCT05367271	clinicaltrials
NCT05369364	clinicaltrials
NCT05372315	clinicaltrials
NCT05372354	clinicaltrials
NCT05387941	clinicaltrials
NCT05392946	clinicaltrials
NCT05405166	clinicaltrials
NCT05422027	clinicaltrials
NCT05432414	clinicaltrials
NCT05432934	clinicaltrials
NCT05434689	clinicaltrials
NCT05435547	clinicaltrials
NCT05438043	clinicaltrials
NCT05439798	clinicaltrials
NCT05439798	clinicaltrials
NCT05441761	clinicaltrials
NCT05451771	clinicaltrials
NCT05451771	clinicaltrials
NCT05451771	clinicaltrials
NCT05455320	clinicaltrials
NCT05456542	clinicaltrials
NCT05459571	clinicaltrials
NCT05465681	clinicaltrials
NCT05466604	clinicaltrials
NCT05469893	clinicaltrials
NCT05470530	clinicaltrials
NCT05476770	clinicaltrials
NCT05478993	clinicaltrials
NCT05479578	clinicaltrials
NCT05484648	clinicaltrials
NCT05486481	clinicaltrials
NCT05487508	clinicaltrials
NCT05488847	clinicaltrials
NCT05491304	clinicaltrials
NCT05493618	clinicaltrials
NCT05495035	clinicaltrials
NCT05496764	clinicaltrials
NCT05497804	clinicaltrials
NCT05498220	clinicaltrials
NCT05504967	clinicaltrials
NCT05509374	clinicaltrials
NCT05509634	clinicaltrials
NCT05509634	clinicaltrials
NCT05514990	clinicaltrials
NCT05518383	clinicaltrials
NCT05518383	clinicaltrials
NCT05518383	clinicaltrials
NCT05519085	clinicaltrials
NCT05521087	clinicaltrials
NCT05522465	clinicaltrials
NCT05527340	clinicaltrials
NCT05530421	clinicaltrials
NCT05533281	clinicaltrials
NCT05546060	clinicaltrials
NCT05546359	clinicaltrials
NCT05549895	clinicaltrials
NCT05550350	clinicaltrials
NCT05550363	clinicaltrials
NCT05552222	clinicaltrials
NCT05552976	clinicaltrials
NCT05553496	clinicaltrials
NCT05558319	clinicaltrials
NCT05560399	clinicaltrials
NCT05561387	clinicaltrials
NCT05561725	clinicaltrials
NCT05563155	clinicaltrials
NCT05564286	clinicaltrials
NCT05567094	clinicaltrials
NCT05572515	clinicaltrials
NCT05573802	clinicaltrials
NCT05581875	clinicaltrials
NCT05583214	clinicaltrials
NCT05583617	clinicaltrials
NCT05587231	clinicaltrials
NCT05590923	clinicaltrials
NCT05598255	clinicaltrials
NCT05608837	clinicaltrials
NCT05620901	clinicaltrials
NCT05623020	clinicaltrials
NCT05626478	clinicaltrials
NCT05634369	clinicaltrials
NCT05638087	clinicaltrials
NCT05641324	clinicaltrials
NCT05645718	clinicaltrials
NCT05647512	clinicaltrials
NCT05654649	clinicaltrials
NCT05655130	clinicaltrials
NCT05656521	clinicaltrials
NCT05658640	clinicaltrials
NCT05660473	clinicaltrials
NCT05663866	clinicaltrials
NCT05665140	clinicaltrials
NCT05665270	clinicaltrials
NCT05667324	clinicaltrials
NCT05668455	clinicaltrials
NCT05669989	clinicaltrials
NCT05675319	clinicaltrials
NCT05675319	clinicaltrials
NCT05675319	clinicaltrials
NCT05679765	clinicaltrials
NCT05681260	clinicaltrials
NCT05687981	clinicaltrials
NCT05688475	clinicaltrials
NCT05690984	clinicaltrials
NCT05692245	clinicaltrials
NCT05693467	clinicaltrials
NCT05695508	clinicaltrials
NCT05697809	clinicaltrials
NCT05704049	clinicaltrials
NCT05711823	clinicaltrials
NCT05714839	clinicaltrials
NCT05716945	clinicaltrials
NCT05719701	clinicaltrials
NCT05720949	clinicaltrials
NCT05721027	clinicaltrials
NCT05727163	clinicaltrials
NCT05730036	clinicaltrials
NCT05731960	clinicaltrials
NCT05732532	clinicaltrials
NCT05732883	clinicaltrials
NCT05736081	clinicaltrials
NCT05736419	clinicaltrials
NCT05745714	clinicaltrials
NCT05751044	clinicaltrials
NCT05751187	clinicaltrials
NCT05752305	clinicaltrials
NCT05761730	clinicaltrials
NCT05773664	clinicaltrials
NCT05774028	clinicaltrials
NCT05776940	clinicaltrials
NCT05776940	clinicaltrials
NCT05787574	clinicaltrials
NCT05789303	clinicaltrials
NCT05791721	clinicaltrials
NCT05793060	clinicaltrials
NCT05804032	clinicaltrials
NCT05805800	clinicaltrials
NCT05809011	clinicaltrials
NCT05820763	clinicaltrials
NCT05824832	clinicaltrials
NCT05841121	clinicaltrials
NCT05848687	clinicaltrials
NCT05852717	clinicaltrials
NCT05857982	clinicaltrials
NCT05861297	clinicaltrials
NCT05871073	clinicaltrials
NCT05872893	clinicaltrials
NCT05887765	clinicaltrials
NCT05887778	clinicaltrials
NCT05895838	clinicaltrials
NCT05896228	clinicaltrials
NCT05900882	clinicaltrials
NCT05909826	clinicaltrials
NCT05911321	clinicaltrials
NCT05918796	clinicaltrials
NCT05922501	clinicaltrials
NCT05932524	clinicaltrials
NCT05943691	clinicaltrials
NCT05965492	clinicaltrials
NCT05966233	clinicaltrials
NCT05974501	clinicaltrials
NCT05977998	clinicaltrials
NCT05980546	clinicaltrials
NCT05981209	clinicaltrials
NCT05986318	clinicaltrials
NCT05988671	clinicaltrials
NCT05990829	clinicaltrials
NCT05991388	clinicaltrials
NCT05994183	clinicaltrials
NCT05996133	clinicaltrials
NCT05996406	clinicaltrials
NCT05998317	clinicaltrials
NCT06006624	clinicaltrials
NCT06008795	clinicaltrials
NCT06016465	clinicaltrials
NCT06017167	clinicaltrials
NCT06019728	clinicaltrials
NCT06022939	clinicaltrials
NCT06023043	clinicaltrials
NCT06042426	clinicaltrials
NCT06042725	clinicaltrials
NCT06043336	clinicaltrials
NCT06044480	clinicaltrials
NCT06050512	clinicaltrials
NCT06074263	clinicaltrials
NCT06082934	clinicaltrials
NCT06083922	clinicaltrials
NCT06086392	clinicaltrials
NCT06086418	clinicaltrials
NCT06086431	clinicaltrials
NCT06099366	clinicaltrials
NCT06099366	clinicaltrials
NCT06104449	clinicaltrials
NCT06118710	clinicaltrials
NCT06126354	clinicaltrials
NCT06128369	clinicaltrials
NCT06132685	clinicaltrials
NCT06136598	clinicaltrials
NCT06136624	clinicaltrials
NCT06136650	clinicaltrials
NCT06137924	clinicaltrials
NCT06140966	clinicaltrials
NCT06142396	clinicaltrials
NCT06152575	clinicaltrials
NCT06158841	clinicaltrials
NCT06160180	clinicaltrials
NCT06160791	clinicaltrials
NCT06163898	clinicaltrials
NCT06169215	clinicaltrials
NCT06172257	clinicaltrials
NCT06173466	clinicaltrials
NCT06176235	clinicaltrials
NCT06182774	clinicaltrials
NCT06187441	clinicaltrials
NCT06189833	clinicaltrials
NCT06203912	clinicaltrials
NCT06207123	clinicaltrials
NCT06207305	clinicaltrials
NCT06208150	clinicaltrials
NCT06208917	clinicaltrials
NCT06209047	clinicaltrials
NCT06210750	clinicaltrials
NCT06212336	clinicaltrials
NCT06216158	clinicaltrials
NCT06222723	clinicaltrials
NCT06230224	clinicaltrials
NCT06232044	clinicaltrials
NCT06232707	clinicaltrials
NCT06233565	clinicaltrials
NCT06233604	clinicaltrials
NCT06233617	clinicaltrials
NCT06235567	clinicaltrials
NCT06241547	clinicaltrials
NCT06259006	clinicaltrials
NCT06266481	clinicaltrials
NCT06268704	clinicaltrials
NCT06269900	clinicaltrials
NCT06272383	clinicaltrials
NCT06288035	clinicaltrials
NCT06289673	clinicaltrials
NCT06300099	clinicaltrials
NCT06304324	clinicaltrials
NCT06305754	clinicaltrials
NCT06317662	clinicaltrials
NCT06331520	clinicaltrials
NCT06336395	clinicaltrials
NCT06342466	clinicaltrials
NCT06348108	clinicaltrials
NCT06348147	clinicaltrials
NCT06351644	clinicaltrials
NCT06353022	clinicaltrials
NCT06353386	clinicaltrials
NCT06356571	clinicaltrials
NCT06361329	clinicaltrials
NCT06367855	clinicaltrials
NCT06376721	clinicaltrials
NCT06387121	clinicaltrials
NCT06390319	clinicaltrials
NCT06408974	clinicaltrials
NCT06413498	clinicaltrials
NCT06429306	clinicaltrials
NCT06429982	clinicaltrials
NCT06432712	clinicaltrials
NCT06433947	clinicaltrials
NCT06437054	clinicaltrials
NCT06464991	clinicaltrials
NCT06465992	clinicaltrials
NCT06470100	clinicaltrials
NCT06470139	clinicaltrials
NCT06470204	clinicaltrials
NCT06470334	clinicaltrials
Molport-003-846-433	molport
824	drugcentral
18207	bindingdb
The data in this table is sourced from UniChem at EBI.