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CHEBI:758427 - btx-a51

Default Structure
ChEBI IDCHEBI:758427
ChEBI Namebtx-a51
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC18H25ClN6
Net Charge0
Average Mass360.893
Monoisotopic Mass360.18292
SMILESCn1ncc(-c2nc(N[C@H]3CC[C@H](N)CC3)ncc2Cl)c1CC1CC1
InChIInChI=1S/C18H25ClN6/c1-25-16(8-11-2-3-11)14(9-22-25)17-15(19)10-21-18(24-17)23-13-6-4-12(20)5-7-13/h9-13H,2-8,20H2,1H3,(H,21,23,24)/t12-,13-
InChIKeyRVZJFCNYSSUDCU-JOCQHMNTSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
btx-a51 (CHEBI:758427) has role antineoplastic agent (CHEBI:35610)
btx-a51 (CHEBI:758427) is a organohalogen compound (CHEBI:17792)
btx-a51 (CHEBI:758427) is a pyrimidines (CHEBI:39447)
Synonym  Source
Btx-a51ChEMBL
Citations