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CHEBI:748338 - irx-4204

Default Structure
ChEBI IDCHEBI:748338
ChEBI Nameirx-4204
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC24H32O2
Net Charge0
Average Mass352.518
Monoisotopic Mass352.24023
SMILES[H][C@@]1(/C=C/C(C)=C/C(=O)O)C[C@]1(C)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIInChI=1S/C24H32O2/c1-16(13-21(25)26)7-8-18-15-24(18,6)17-9-10-19-20(14-17)23(4,5)12-11-22(19,2)3/h7-10,13-14,18H,11-12,15H2,1-6H3,(H,25,26)/b8-7+,16-13+/t18-,24-/m1/s1
InChIKeyBOOOLEGQBVUTKC-NVQSDHBMSA-N
Roles Classification
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
antiparkinson drug  A drug used in the treatment of Parkinson's disease.
ChEBI Ontology
Outgoing Relation(s)
irx-4204 (CHEBI:748338) has role antineoplastic agent (CHEBI:35610)
irx-4204 (CHEBI:748338) has role antiparkinson drug (CHEBI:48407)
irx-4204 (CHEBI:748338) is a tetralins (CHEBI:36786)
Synonyms  Source
AGN-194204ChEMBL
AGN194204ChEMBL
Irx-4204ChEMBL
KB-145960ChEMBL
NRX-194204ChEMBL
NRX194204ChEMBL
Citations