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CHEBI:189296 - Butyl 4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

ChEBI IDCHEBI:189296
ChEBI NameButyl 4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H31NO5
Net Charge0
Average Mass413.514
Monoisotopic Mass413.22022
SMILESCCCCOC(=O)C1=C(C)NC2=C(C(=O)CCC2)C1c1ccc(OCC)c(OC)c1
InChIInChI=1S/C24H31NO5/c1-5-7-13-30-24(27)21-15(3)25-17-9-8-10-18(26)23(17)22(21)16-11-12-19(29-6-2)20(14-16)28-4/h11-12,14,22,25H,5-10,13H2,1-4H3
InChIKeySVPHDYMYUJTPMO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
Butyl 4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate (CHEBI:189296) is a quinolines (CHEBI:26513)
IUPAC Name 
butyl 4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Manual XrefsDatabases
540294ChemSpider