EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:749032 - canertinib dihydrochloride

Default Structure
ChEBI IDCHEBI:749032
ChEBI Namecanertinib dihydrochloride
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaHCl.C24H25ClFN5O3.HCl
Net Charge0
Average Mass558.869
Monoisotopic Mass557.11635
SMILESC=CC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCCCN1CCOCC1.Cl.Cl
InChIInChI=1S/C24H25ClFN5O3.2ClH/c1-2-23(32)30-21-13-17-20(14-22(21)34-9-3-6-31-7-10-33-11-8-31)27-15-28-24(17)29-16-4-5-19(26)18(25)12-16;;/h2,4-5,12-15H,1,3,6-11H2,(H,30,32)(H,27,28,29);2*1H
InChIKeyJZZFDCXSFTVOJY-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
canertinib dihydrochloride (CHEBI:749032) has role antineoplastic agent (CHEBI:35610)
canertinib dihydrochloride (CHEBI:749032) is a quinazolines (CHEBI:38530)
Synonyms  Source
Canertinib dihydrochlorideChEMBL
Canertinib hydrochlorideChEMBL
PD-0183805ChEMBL
PD-0183805-002BChEMBL
PD-183805ChEMBL
SN-26606ChEMBL
Citations