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CHEBI:756011 - emd-1204831

Default Structure
ChEBI IDCHEBI:756011
ChEBI Nameemd-1204831
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC25H27N7O3
Net Charge0
Average Mass473.537
Monoisotopic Mass473.21754
SMILESCn1cc(-c2ccc(=O)n(Cc3cccc(-c4ncc(OCCN5CCOCC5)cn4)c3)n2)cn1
InChIInChI=1S/C25H27N7O3/c1-30-18-21(14-28-30)23-5-6-24(33)32(29-23)17-19-3-2-4-20(13-19)25-26-15-22(16-27-25)35-12-9-31-7-10-34-11-8-31/h2-6,13-16,18H,7-12,17H2,1H3
InChIKeyCIUKPBWULKEZMF-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
emd-1204831 (CHEBI:756011) has role antineoplastic agent (CHEBI:35610)
emd-1204831 (CHEBI:756011) is a pyridazinone (CHEBI:26414)
Synonym  Source
Emd-1204831ChEMBL