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CHEBI:189491 - Methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)methyl]-2-furyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

ChEBI IDCHEBI:189491
ChEBI NameMethyl 4-{5-[(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)methyl]-2-furyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H22N2O6
Net Charge0
Average Mass446.459
Monoisotopic Mass446.14779
SMILESCOC(=O)C1=C(C)NC2=C(C(=O)CCC2)C1c1ccc(CN2C(=O)c3ccccc3C2=O)o1
InChIInChI=1S/C25H22N2O6/c1-13-20(25(31)32-2)22(21-17(26-13)8-5-9-18(21)28)19-11-10-14(33-19)12-27-23(29)15-6-3-4-7-16(15)24(27)30/h3-4,6-7,10-11,22,26H,5,8-9,12H2,1-2H3
InChIKeyOJTFHUFNAFJJTC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) leaf sheath (BTO:0005094) MetaboLights (MTBLS3518)
ChEBI Ontology
Outgoing Relation(s)
Methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)methyl]-2-furyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate (CHEBI:189491) is a phthalimides (CHEBI:82851)
IUPAC Name 
methyl 4-[5-[(1,3-dioxoisoindol-2-yl)methyl]uran-2-yl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Manual XrefsDatabases
2089198ChemSpider