EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:177636 - Bevenopran

ChEBI IDCHEBI:177636
ChEBI NameBevenopran
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26N4O4
Net Charge0
Average Mass386.452
Monoisotopic Mass386.19541
SMILESCOc1cc(CNCCC2CCOCC2)ccc1Oc1cnc(C(N)=O)cn1
InChIInChI=1S/C20H26N4O4/c1-26-18-10-15(11-22-7-4-14-5-8-27-9-6-14)2-3-17(18)28-19-13-23-16(12-24-19)20(21)25/h2-3,10,12-14,22H,4-9,11H2,1H3,(H2,21,25)
InChIKeyZGCYVRNZWGUXNQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Bevenopran (CHEBI:177636) is a aromatic ether (CHEBI:35618)
IUPAC Name 
5-[2-methoxy-4-[[2-(oxan-4-yl)ethylamino]methyl]phenoxy]pyrazine-2-carboxamide
Manual XrefsDatabases
8628148ChemSpider
D10349KEGG DRUG
DB12464DrugBank
Registry NumbersSources
CAS:676500-67-7ChemIDplus