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CHEBI:230491 - BMS961

Default Structure
ChEBI IDCHEBI:230491
ChEBI NameBMS961
Stars
DefinitionBMS961 is a selective retinoic acid receptor gamma (RARgamma) agonist
Submitterdelphine
DownloadsMolfile
FormulaC23H26FNO4
Net Charge0
Average Mass399.462
Monoisotopic Mass399.18459
SMILESCC1(C)CCC(C)(C)c2cc(C(O)C(=O)Nc3ccc(C(=O)O)cc3F)ccc21
InChIInChI=1S/C23H26FNO4/c1-22(2)9-10-23(3,4)16-11-13(5-7-15(16)22)19(26)20(27)25-18-8-6-14(21(28)29)12-17(18)24/h5-8,11-12,19,26H,9-10H2,1-4H3,(H,25,27)(H,28,29)
InChIKeyAANFHDFOMFRLLR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
BMS961 (CHEBI:230491) is a organic molecular entity (CHEBI:50860)
Registry NumbersSources
CAS:185629-22-5SUBMITTER