CHEBI:231416 - danicopan

ChEBI IDCHEBI:231416
ChEBI Namedanicopan
Stars
Last Modified28 May 2024
SubmitterAdnan
DownloadsMolfile
FormulaC26H23BrFN7O3
Net Charge0
Average Mass580.418
Monoisotopic Mass579.10298
SMILESCC(=O)c1nn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(Br)n2)c2ccc(-c3cnc(C)nc3)cc12
InChIInChI=1S/C26H23BrFN7O3/c1-14(36)25-19-8-16(17-10-29-15(2)30-11-17)6-7-20(19)35(33-25)13-24(37)34-12-18(28)9-21(34)26(38)32-23-5-3-4-22(27)31-23/h3-8,10-11,18,21H,9,12-13H2,1-2H3,(H,31,32,38)/t18-,21+/m1/s1
InChIKeyPIBARDGJJAGJAJ-NQIIRXRSSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
danicopan (CHEBI:231416) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
D11641KEGG DRUG
DanicopanWikipedia
DB15401DrugBank