EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:758190 - temuterkib

Default Structure
ChEBI IDCHEBI:758190
ChEBI Nametemuterkib
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H27N7O2S
Net Charge0
Average Mass453.572
Monoisotopic Mass453.19469
SMILESCn1nccc1Nc1nccc(-c2cc3c(s2)C(C)(C)N(CCN2CCOCC2)C3=O)n1
InChIInChI=1S/C22H27N7O2S/c1-22(2)19-15(20(30)29(22)9-8-28-10-12-31-13-11-28)14-17(32-19)16-4-6-23-21(25-16)26-18-5-7-24-27(18)3/h4-7,14H,8-13H2,1-3H3,(H,23,25,26)
InChIKeyJNPRPMBJODOFEC-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
temuterkib (CHEBI:758190) has role antineoplastic agent (CHEBI:35610)
temuterkib (CHEBI:758190) is a thiophenes (CHEBI:26961)
INN  Source
temuterkibWHO MedNet
Synonyms  Source
Ly 3214996ChEMBL
LY-3214996ChEMBL
LY3214996ChEMBL
Citations