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CHEBI:758652 - iruplinalkib

Default Structure
ChEBI IDCHEBI:758652
ChEBI Nameiruplinalkib
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H38ClN6O2P
Net Charge0
Average Mass569.090
Monoisotopic Mass568.24824
SMILESCOc1cc(N2CCC3(CCN(C)CC3)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1
InChIInChI=1S/C29H38ClN6O2P/c1-35-15-11-29(12-16-35)13-17-36(18-14-29)21-9-10-23(25(19-21)38-2)33-28-31-20-22(30)27(34-28)32-24-7-5-6-8-26(24)39(3,4)37/h5-10,19-20H,11-18H2,1-4H3,(H2,31,32,33,34)
InChIKeyZPCCNHQDFZCULN-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
iruplinalkib (CHEBI:758652) has role antineoplastic agent (CHEBI:35610)
iruplinalkib (CHEBI:758652) is a piperidines (CHEBI:26151)
INN  Source
iruplinalkibWHO MedNet
Citations