xl-418 (CHEBI:750372)

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CHEBI:750372 - xl-418

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ChEBI ID	CHEBI:750372
ChEBI Name	xl-418
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C26H32BrF3N8O
Net Charge	0
Average Mass	609.495
Monoisotopic Mass	608.18345
SMILES	Cc1c(NCCN2CCCC2)cc(C(=O)CCC(F)(F)F)cc1N1CCN(c2ncnc3nnc(Br)c23)CC1
InChI	InChI=1S/C26H32BrF3N8O/c1-17-19(31-6-9-36-7-2-3-8-36)14-18(21(39)4-5-26(28,29)30)15-20(17)37-10-12-38(13-11-37)25-22-23(27)34-35-24(22)32-16-33-25/h14-16,31H,2-13H2,1H3,(H,32,33,34,35)
InChIKey	IKBSEBRGSVFUHM-UHFFFAOYSA-N

Roles Classification

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology

Outgoing Relation(s)
	xl-418 (CHEBI:750372) has role antineoplastic agent (CHEBI:35610)
	xl-418 (CHEBI:750372) is a aromatic ketone (CHEBI:76224)

Synonyms	Source
Xl-418	ChEMBL
XL418	ChEMBL

Citations