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CHEBI:31559 - Esonarimod

ChEBI IDCHEBI:31559
ChEBI NameEsonarimod
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC14H16O4S
Net Charge0
Average Mass280.345
Monoisotopic Mass280.07693
SMILESCC(=O)SCC(CC(=O)c1ccc(C)cc1)C(=O)O
InChIInChI=1S/C14H16O4S/c1-9-3-5-11(6-4-9)13(16)7-12(14(17)18)8-19-10(2)15/h3-6,12H,7-8H2,1-2H3,(H,17,18)
InChIKeyYRSSFEUQNAXQMX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Esonarimod (CHEBI:31559) is a aromatic ketone (CHEBI:76224)
Synonym  Source
EsonarimodKEGG COMPOUND
Manual XrefsDatabases
D01102KEGG DRUG
Registry NumbersSources
CAS:101973-77-7KEGG COMPOUND