CHEBI:109741 - 5-[3-(2-chloro-6-methoxy-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid

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ChEBI Name 5-[3-(2-chloro-6-methoxy-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
ChEBI ID CHEBI:109741
Stars This entity has been manually annotated by a third party.
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Formula C22H20ClN3O5
Net Charge 0
Average Mass 441.865
Monoisotopic Mass 441.10915
InChI InChI=1S/C22H20ClN3O5/c1-30-14-7-8-16-13(10-14)11-15(22(23)24-16)18-12-17(19-4-3-9-31-19)25-26(18)20(27)5-2-6-21(28)29/h3-4,7-11,18H,2,5-6,12H2,1H3,(H,28,29)
InChIKey HLSPTDWBJQDVGR-UHFFFAOYSA-N
SMILES COC1=CC2=CC(=C(N=C2C=C1)Cl)C3CC(=NN3C(=O)CCCC(=O)O)C4=CC=CO4
ChEBI Ontology
Outgoing 5-[3-(2-chloro-6-methoxy-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid (CHEBI:109741) is a organochlorine compound (CHEBI:36683)
5-[3-(2-chloro-6-methoxy-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid (CHEBI:109741) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-21169 LINCS
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