CHEBI:177517 - Bifeprunox

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Bifeprunox
ChEBI ID CHEBI:177517
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H23N3O2
Net Charge 0
Average Mass 385.467
Monoisotopic Mass 385.17903
InChI InChI=1S/C24H23N3O2/c28-24-25-21-10-5-11-22(23(21)29-24)27-14-12-26(13-15-27)17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-11,16H,12-15,17H2,(H,25,28)
InChIKey CYGODHVAJQTCBG-UHFFFAOYSA-N
SMILES O1C=2C(N3CCN(CC3)CC4=CC(=CC=C4)C5=CC=CC=C5)=CC=CC2NC1=O
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing Bifeprunox (CHEBI:177517) is a biphenyls (CHEBI:22888)
IUPAC Name
7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3H-1,3-benzoxazol-2-one
Manual Xrefs Databases
181044 ChemSpider
D06566 KEGG DRUG
DB04888 KEGG DRUG
View more database links
Registry Number Type Source
350992-10-8 CAS Registry Number ChemIDplus