EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:759184 - pumecitinib

Default Structure
ChEBI IDCHEBI:759184
ChEBI Namepumecitinib
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC17H20N8O2S
Net Charge0
Average Mass400.468
Monoisotopic Mass400.14299
SMILESCC(C)S(=O)(=O)N1CC(CC#N)(n2cc(-c3ncnc4nccc34)c(N)n2)C1
InChIInChI=1S/C17H20N8O2S/c1-11(2)28(26,27)24-8-17(9-24,4-5-18)25-7-13(15(19)23-25)14-12-3-6-20-16(12)22-10-21-14/h3,6-7,10-11H,4,8-9H2,1-2H3,(H2,19,23)(H,20,21,22)
InChIKeyOUXYFMCMGWQWQF-UHFFFAOYSA-N
Roles Classification
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
pumecitinib (CHEBI:759184) has role anti-inflammatory agent (CHEBI:67079)
pumecitinib (CHEBI:759184) is a pyrrolopyrimidine (CHEBI:38670)
INN  Source
pumecitinibWHO MedNet