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CHEBI:758418 - etrumadenant

Default Structure
ChEBI IDCHEBI:758418
ChEBI Nameetrumadenant
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H22N8O
Net Charge0
Average Mass426.484
Monoisotopic Mass426.19166
SMILESCc1c(C#N)cccc1-c1cc(-c2cn(Cc3cccc(C(C)(C)O)n3)nn2)nc(N)n1
InChIInChI=1S/C23H22N8O/c1-14-15(11-24)6-4-8-17(14)18-10-19(28-22(25)27-18)20-13-31(30-29-20)12-16-7-5-9-21(26-16)23(2,3)32/h4-10,13,32H,12H2,1-3H3,(H2,25,27,28)
InChIKeyBUXIAWLTBSXYSW-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
etrumadenant (CHEBI:758418) has role antineoplastic agent (CHEBI:35610)
etrumadenant (CHEBI:758418) is a benzenes (CHEBI:22712)
etrumadenant (CHEBI:758418) is a nitrile (CHEBI:18379)
INN  Source
etrumadenantWHO MedNet
Synonyms  Source
AB-928ChEMBL
AB928ChEMBL
Citations