CHEBI:81892 - Brodifacoum

ChEBI IDCHEBI:81892
ChEBI NameBrodifacoum
Stars
DownloadsMolfile
FormulaC31H23BrO3
Net Charge0
Average Mass523.426
Monoisotopic Mass522.08306
SMILESO=c1oc2ccccc2c(O)c1C1CC(c2ccc(-c3ccc(Br)cc3)cc2)Cc2ccccc21
InChIInChI=1S/C31H23BrO3/c32-24-15-13-20(14-16-24)19-9-11-21(12-10-19)23-17-22-5-1-2-6-25(22)27(18-23)29-30(33)26-7-3-4-8-28(26)35-31(29)34/h1-16,23,27,33H,17-18H2
InChIKeyVEUZZDOCACZPRY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Brodifacoum (CHEBI:81892) is a benzenes (CHEBI:22712)
Brodifacoum (CHEBI:81892) is a naphthalenes (CHEBI:25477)
Brodifacoum (CHEBI:81892) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
C18694KEGG COMPOUND
87PPDB
Registry NumbersSources
CAS:56073-10-0KEGG COMPOUND