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CHEBI:232618 - broxaldine

Default Structure
ChEBI IDCHEBI:232618
ChEBI Namebroxaldine
Stars
Definitionroxaldine (Brobenzoxaldine) is an antiprotozoal agent. Broxaldine inhibits Clostridium difficile with a MIC value of 4 uM, and has antifungal effects.
Submitterruixy
DownloadsMolfile
FormulaC17H11Br2NO2
Net Charge0
Average Mass421.088
Monoisotopic Mass418.91565
SMILESCc1ccc2c(Br)cc(Br)c(OC(=O)c3ccccc3)c2n1
InChIInChI=1S/C17H11Br2NO2/c1-10-7-8-12-13(18)9-14(19)16(15(12)20-10)22-17(21)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyIJTPLVAAROHGGB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
broxaldine (CHEBI:232618) is a organic molecular entity (CHEBI:50860)
Synonym  Source
BrobenzoxaldineSUBMITTER
Registry NumbersSources
CAS:3684-46-6SUBMITTER