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CHEBI:31385 - Celiprolol hydrochloride

ChEBI IDCHEBI:31385
ChEBI NameCeliprolol hydrochloride
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC20H33N3O4.HCl
Net Charge0
Average Mass415.962
Monoisotopic Mass415.22378
SMILESCCN(CC)C(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(C(C)=O)c1.Cl
InChIInChI=1S/C20H33N3O4.ClH/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6;/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26);1H
InChIKeyVKJHTUVLJYWAEY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Celiprolol hydrochloride (CHEBI:31385) is a aromatic ketone (CHEBI:76224)
Synonym  Source
Celiprolol hydrochlorideKEGG COMPOUND
Manual XrefsDatabases
D01741KEGG DRUG
Registry NumbersSources
CAS:57470-78-7KEGG COMPOUND