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CHEBI:51544 - BMY 45778

ChEBI IDCHEBI:51544
ChEBI NameBMY 45778
Stars
Last Modified25 February 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC26H18N2O5
Net Charge0
Average Mass438.439
Monoisotopic Mass438.12157
SMILESO=C(O)COc1cccc(-c2ocnc2-c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1
InChIInChI=1S/C26H18N2O5/c29-21(30)15-31-20-13-7-12-19(14-20)24-23(27-16-32-24)26-28-22(17-8-3-1-4-9-17)25(33-26)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,29,30)
InChIKeyDSRSEEYZGWTODH-UHFFFAOYSA-N
Roles Classification
Application:
partial prostacyclin agonist  A compound which binds and activates the prostacyclin receptor IP1, but has only partial efficacy at the receptor relative to a full agonist.
ChEBI Ontology
Outgoing Relation(s)
BMY 45778 (CHEBI:51544) has role partial prostacyclin agonist (CHEBI:51577)
BMY 45778 (CHEBI:51544) is a bisoxazole (CHEBI:51562)
IUPAC Name 
[3-(4,5-diphenyl-2,4'-bi-1,3-oxazol-5'-yl)phenoxy]acetic acid
Synonyms  Source
Bmy 45778ChemIDplus
Bmy-45778ChemIDplus
Manual XrefsDatabases
LSM-3901LINCS
Registry NumbersSources
Beilstein:6671146Beilstein
CAS:152575-66-1ChemIDplus