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CHEBI:755283 - spebrutinib besylate

Default Structure
ChEBI IDCHEBI:755283
ChEBI Namespebrutinib besylate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H22FN5O3.C6H6O3S
Net Charge0
Average Mass581.626
Monoisotopic Mass581.17443
SMILESC=CC(=O)Nc1cccc(Nc2nc(Nc3ccc(OCCOC)cc3)ncc2F)c1.O=S(=O)(O)c1ccccc1
InChIInChI=1S/C22H22FN5O3.C6H6O3S/c1-3-20(29)25-16-5-4-6-17(13-16)26-21-19(23)14-24-22(28-21)27-15-7-9-18(10-8-15)31-12-11-30-2;7-10(8,9)6-4-2-1-3-5-6/h3-10,13-14H,1,11-12H2,2H3,(H,25,29)(H2,24,26,27,28);1-5H,(H,7,8,9)
InChIKeyABSXPNGWJFAPRT-UHFFFAOYSA-N
Roles Classification
Applications:
antirheumatic drug  A drug used to treat rheumatoid arthritis.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
spebrutinib besylate (CHEBI:755283) has role antineoplastic agent (CHEBI:35610)
spebrutinib besylate (CHEBI:755283) has role antirheumatic drug (CHEBI:35842)
spebrutinib besylate (CHEBI:755283) is a organosulfur compound (CHEBI:33261)
spebrutinib besylate (CHEBI:755283) is a sulfonic acid derivative (CHEBI:33552)
Synonyms  Source
AVL-292ChEMBL
AVL-292 BESYLATEChEMBL
CC-292ChEMBL
CC-292 BESYLATEChEMBL
SpebrutinibChEMBL
Spebrutinib besilateChEMBL