EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:756002 - bms-852927

Default Structure
ChEBI IDCHEBI:756002
ChEBI Namebms-852927
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H28Cl2F2N2O4S
Net Charge0
Average Mass609.522
Monoisotopic Mass608.11149
SMILESCC(C)(O)c1cn(-c2ccc(-c3cc(F)c(CO)c(S(C)(=O)=O)c3)cc2F)c(C(C)(C)c2c(Cl)cccc2Cl)n1
InChIInChI=1S/C29H28Cl2F2N2O4S/c1-28(2,26-19(30)7-6-8-20(26)31)27-34-25(29(3,4)37)14-35(27)23-10-9-16(11-22(23)33)17-12-21(32)18(15-36)24(13-17)40(5,38)39/h6-14,36-37H,15H2,1-5H3
InChIKeyHNAJDMYOTDNOBK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
bms-852927 (CHEBI:756002) is a imidazoles (CHEBI:24780)
Synonyms  Source
Bms-852927ChEMBL
EXEL-04541041ChEMBL
XL-041ChEMBL
Citations