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CHEBI:759123 - theliatinib

Default Structure
ChEBI IDCHEBI:759123
ChEBI Nametheliatinib
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC25H26N6O2
Net Charge0
Average Mass442.523
Monoisotopic Mass442.21172
SMILES[H][C@]12CCN(C)[C@@]1([H])CN(C(=O)Nc1cc3c(Nc4cccc(C#C)c4)ncnc3cc1OC)C2
InChIInChI=1S/C25H26N6O2/c1-4-16-6-5-7-18(10-16)28-24-19-11-21(23(33-3)12-20(19)26-15-27-24)29-25(32)31-13-17-8-9-30(2)22(17)14-31/h1,5-7,10-12,15,17,22H,8-9,13-14H2,2-3H3,(H,29,32)(H,26,27,28)/t17-,22+/m1/s1
InChIKeyFSXCKIBROURMFT-VGSWGCGISA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
theliatinib (CHEBI:759123) has role antineoplastic agent (CHEBI:35610)
theliatinib (CHEBI:759123) is a quinazolines (CHEBI:38530)
INN  Source
xiliertinibWHO MedNet
Synonyms  Source
HMPL-309ChEMBL
TheliatinibChEMBL