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CHEBI:759066 - berotralstat

Default Structure
ChEBI IDCHEBI:759066
ChEBI Nameberotralstat
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC30H26F4N6O
Net Charge0
Average Mass562.571
Monoisotopic Mass562.21042
SMILESN#Cc1cccc([C@@H](NCC2CC2)c2ccc(F)c(NC(=O)c3cc(C(F)(F)F)nn3-c3cccc(CN)c3)c2)c1
InChIInChI=1S/C30H26F4N6O/c31-24-10-9-22(28(37-17-18-7-8-18)21-5-1-3-19(11-21)15-35)13-25(24)38-29(41)26-14-27(30(32,33)34)39-40(26)23-6-2-4-20(12-23)16-36/h1-6,9-14,18,28,37H,7-8,16-17,36H2,(H,38,41)/t28-/m1/s1
InChIKeyUXNXMBYCBRBRFD-MUUNZHRXSA-N
ChEBI Ontology
Outgoing Relation(s)
berotralstat (CHEBI:759066) is a aromatic amide (CHEBI:62733)
Synonyms  Source
BCX-7353ChEMBL
BCX7353ChEMBL
BerotralstatChEMBL
Citations