EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:759258 - paltusotine hydrochloride

Default Structure
ChEBI IDCHEBI:759258
ChEBI Namepaltusotine hydrochloride
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC27H22F2N4O.HCl
Net Charge0
Average Mass492.957
Monoisotopic Mass492.15285
SMILESCl.N#Cc1cccc(-c2ccc3ncc(-c4cc(F)cc(F)c4)c(N4CCC(N)CC4)c3c2)c1O
InChIInChI=1S/C27H22F2N4O.ClH/c28-19-10-18(11-20(29)13-19)24-15-32-25-5-4-16(22-3-1-2-17(14-30)27(22)34)12-23(25)26(24)33-8-6-21(31)7-9-33;/h1-5,10-13,15,21,34H,6-9,31H2;1H
InChIKeyBPVXAUKYSITSMT-UHFFFAOYSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
paltusotine hydrochloride (CHEBI:759258) has role antineoplastic agent (CHEBI:35610)
paltusotine hydrochloride (CHEBI:759258) is a diarylheptanoid (CHEBI:78802)
Synonyms  Source
CRN00808.HClChEMBL
CRN-00808 HYDROCHLORIDEChEMBL
Paltusotine hydrochlorideChEMBL