Dataset

Sildenafil; LC-ESI-QTOF; MS2; 50 V

This MassBank record with Accession MSBNK-BAFG-CSL2311108933 contains the MS2 mass spectrum of Sildenafil with the InChIkey BNRNXUUZRGQAQC-UHFFFAOYSA-N.

Chemical Information

InChI	InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)
SMILES	CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C
InChI Key	BNRNXUUZRGQAQC-UHFFFAOYSA-N
Molecular Formula	C22H30N6O4S
Exact Mass	474.205 g/mol

Data and Resources

SildenafilHTML

Go to source

Related Molecule ⌄

5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311108933
Version
Author
Maintainer
Language
MetadataPublished	2023-11-10
Related Molecule	5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
DB00203	drugbank
VIA	rcsb_pdb
CHEMBL192	chembl
1895	surechembl
29361663	surechembl
492566	surechembl
8100377	surechembl
135398744	pubchem
3M7OB98Y7H	fdasrs
VIA	pdbe
4743	gtopdb
PD003443	probes_and_drugs
QEGTUT	CCDC
117589	brenda
615	brenda
CHEBI:9139	chebi
HMDB0005039	hmdb
DTXSID6023579	comptox
NCT00056433	clinicaltrials
NCT00133679	clinicaltrials
NCT00145483	clinicaltrials
NCT00145938	clinicaltrials
NCT00175981	clinicaltrials
NCT00194909	clinicaltrials
NCT00223717	clinicaltrials
NCT00245596	clinicaltrials
NCT00249730	clinicaltrials
NCT00251784	clinicaltrials
NCT00273416	clinicaltrials
NCT00302211	clinicaltrials
NCT00303004	clinicaltrials
NCT00309790	clinicaltrials
NCT00309816	clinicaltrials
NCT00313898	clinicaltrials
NCT00334490	clinicaltrials
NCT00352482	clinicaltrials
NCT00359736	clinicaltrials
NCT00375297	clinicaltrials
NCT00407446	clinicaltrials
NCT00420901	clinicaltrials
NCT00431418	clinicaltrials
NCT00433329	clinicaltrials
NCT00452582	clinicaltrials
NCT00454714	clinicaltrials
NCT00455715	clinicaltrials
NCT00461565	clinicaltrials
NCT00483626	clinicaltrials
NCT00491803	clinicaltrials
NCT00492531	clinicaltrials
NCT00498680	clinicaltrials
NCT00498680	clinicaltrials
NCT00507819	clinicaltrials
NCT00527995	clinicaltrials
NCT00547092	clinicaltrials
NCT00547287	clinicaltrials
NCT00547352	clinicaltrials
NCT00586794	clinicaltrials
NCT00598585	clinicaltrials
NCT00617305	clinicaltrials
NCT00624273	clinicaltrials
NCT00625079	clinicaltrials
NCT00640458	clinicaltrials
NCT00644605	clinicaltrials
NCT00644631	clinicaltrials
NCT00644956	clinicaltrials
NCT00645034	clinicaltrials
NCT00645268	clinicaltrials
NCT00648596	clinicaltrials
NCT00654017	clinicaltrials
NCT00654082	clinicaltrials
NCT00655590	clinicaltrials
NCT00659529	clinicaltrials
NCT00692237	clinicaltrials
NCT00730067	clinicaltrials
NCT00742014	clinicaltrials
NCT00746967	clinicaltrials
NCT00752115	clinicaltrials
NCT00763867	clinicaltrials
NCT00767598	clinicaltrials
NCT00780728	clinicaltrials
NCT00781508	clinicaltrials
NCT00793338	clinicaltrials
NCT00795938	clinicaltrials
NCT00796510	clinicaltrials
NCT00796666	clinicaltrials
NCT00800592	clinicaltrials
NCT00814736	clinicaltrials
NCT00815646	clinicaltrials
NCT00818701	clinicaltrials
NCT00853112	clinicaltrials
NCT00862888	clinicaltrials
NCT00866463	clinicaltrials
NCT00872170	clinicaltrials
NCT00902512	clinicaltrials
NCT00906269	clinicaltrials
NCT00914277	clinicaltrials
NCT00937144	clinicaltrials
NCT00940901	clinicaltrials
NCT00950404	clinicaltrials
NCT00964782	clinicaltrials
NCT00972569	clinicaltrials
NCT00975494	clinicaltrials
NCT00981747	clinicaltrials
NCT00981747	clinicaltrials
NCT01027117	clinicaltrials
NCT01046838	clinicaltrials
NCT01055405	clinicaltrials
NCT01060020	clinicaltrials
NCT01091012	clinicaltrials
NCT01107782	clinicaltrials
NCT01132482	clinicaltrials
NCT01156636	clinicaltrials
NCT01168908	clinicaltrials
NCT01169519	clinicaltrials
NCT01179334	clinicaltrials
NCT01185925	clinicaltrials
NCT01194232	clinicaltrials
NCT01244620	clinicaltrials
NCT01254383	clinicaltrials
NCT01254396	clinicaltrials
NCT01290484	clinicaltrials
NCT01295736	clinicaltrials
NCT01315262	clinicaltrials
NCT01334554	clinicaltrials
NCT01350154	clinicaltrials
NCT01352507	clinicaltrials
NCT01359670	clinicaltrials
NCT01360671	clinicaltrials
NCT01364701	clinicaltrials
NCT01375699	clinicaltrials
NCT01382368	clinicaltrials
NCT01392469	clinicaltrials
NCT01409031	clinicaltrials
NCT01409993	clinicaltrials
NCT01432665	clinicaltrials
NCT01449253	clinicaltrials
NCT01481350	clinicaltrials
NCT01499498	clinicaltrials
NCT01514903	clinicaltrials
NCT01517854	clinicaltrials
NCT01558466	clinicaltrials
NCT01580501	clinicaltrials
NCT01601470	clinicaltrials
NCT01616381	clinicaltrials
NCT01642407	clinicaltrials
NCT01668446	clinicaltrials
NCT01670136	clinicaltrials
NCT01720524	clinicaltrials
NCT01726049	clinicaltrials
NCT01737203	clinicaltrials
NCT01757782	clinicaltrials
NCT01762475	clinicaltrials
NCT01800292	clinicaltrials
NCT01853540	clinicaltrials
NCT01889966	clinicaltrials
NCT01913847	clinicaltrials
NCT01936350	clinicaltrials
NCT01941732	clinicaltrials
NCT01954524	clinicaltrials
NCT01986673	clinicaltrials
NCT02028429	clinicaltrials
NCT02050360	clinicaltrials
NCT02057458	clinicaltrials
NCT02106871	clinicaltrials
NCT02114775	clinicaltrials
NCT02136329	clinicaltrials
NCT02162979	clinicaltrials
NCT02244528	clinicaltrials
NCT02277132	clinicaltrials
NCT02284737	clinicaltrials
NCT02304705	clinicaltrials
NCT02335242	clinicaltrials
NCT02337881	clinicaltrials
NCT02345980	clinicaltrials
NCT02364882	clinicaltrials
NCT02378649	clinicaltrials
NCT02387450	clinicaltrials
NCT02390960	clinicaltrials
NCT02435303	clinicaltrials
NCT02442492	clinicaltrials
NCT02519153	clinicaltrials
NCT02524184	clinicaltrials
NCT02595541	clinicaltrials
NCT02626182	clinicaltrials
NCT02663830	clinicaltrials
NCT02682147	clinicaltrials
NCT02766725	clinicaltrials
NCT02782559	clinicaltrials
NCT02795351	clinicaltrials
NCT02802345	clinicaltrials
NCT02812433	clinicaltrials
NCT02832570	clinicaltrials
NCT02850718	clinicaltrials
NCT02891850	clinicaltrials
NCT02908490	clinicaltrials
NCT02930811	clinicaltrials
NCT02939495	clinicaltrials
NCT02946944	clinicaltrials
NCT02951429	clinicaltrials
NCT02975037	clinicaltrials
NCT02983461	clinicaltrials
NCT03027674	clinicaltrials
NCT03053739	clinicaltrials
NCT03142568	clinicaltrials
NCT03154476	clinicaltrials
NCT03169582	clinicaltrials
NCT03192709	clinicaltrials
NCT03199612	clinicaltrials
NCT03229512	clinicaltrials
NCT03230162	clinicaltrials
NCT03236818	clinicaltrials
NCT03259516	clinicaltrials
NCT03262961	clinicaltrials
NCT03382106	clinicaltrials
NCT03402191	clinicaltrials
NCT03406169	clinicaltrials
NCT03460470	clinicaltrials
NCT03462017	clinicaltrials
NCT03510338	clinicaltrials
NCT03633565	clinicaltrials
NCT03686306	clinicaltrials
NCT03696758	clinicaltrials
NCT03733470	clinicaltrials
NCT03755037	clinicaltrials
NCT03763045	clinicaltrials
NCT03855332	clinicaltrials
NCT03945643	clinicaltrials
NCT03997097	clinicaltrials
NCT04039087	clinicaltrials
NCT04039464	clinicaltrials
NCT04039464	clinicaltrials
NCT04052269	clinicaltrials
NCT04100759	clinicaltrials
NCT04211272	clinicaltrials
NCT04283240	clinicaltrials
NCT04325243	clinicaltrials
NCT04356716	clinicaltrials
NCT04447989	clinicaltrials
NCT04489446	clinicaltrials
NCT04538976	clinicaltrials
NCT04718233	clinicaltrials
NCT04770155	clinicaltrials
NCT04797286	clinicaltrials
NCT04882826	clinicaltrials
NCT04908657	clinicaltrials
NCT04948151	clinicaltrials
NCT04985929	clinicaltrials
NCT04994860	clinicaltrials
NCT05183334	clinicaltrials
NCT05201144	clinicaltrials
NCT05275725	clinicaltrials
NCT05466695	clinicaltrials
NCT05490680	clinicaltrials
NCT05556083	clinicaltrials
NCT05584956	clinicaltrials
NCT05684289	clinicaltrials
NCT05753098	clinicaltrials
NCT05765487	clinicaltrials
NCT05782244	clinicaltrials
NCT05971667	clinicaltrials
NCT06064448	clinicaltrials
NCT06098833	clinicaltrials
NCT06123156	clinicaltrials
NCT06289881	clinicaltrials
NCT06324396	clinicaltrials
NCT06377098	clinicaltrials
Molport-001-995-394	molport
Molport-002-885-861	molport
2441	drugcentral
14390	bindingdb
50238854	bindingdb
The data in this table is sourced from UniChem at EBI.