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CHEBI:121472 - 4-[[3-methoxycarbonyl-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-4-oxo-2-butenoic acid

Default Structure
ChEBI IDCHEBI:121472
ChEBI Name4-[[3-methoxycarbonyl-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-4-oxo-2-butenoic acid
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DownloadsMolfile
FormulaC20H21NO5S
Net Charge0
Average Mass387.457
Monoisotopic Mass387.11404
SMILESCOC(=O)c1c(NC(=O)C=CC(=O)O)sc(C)c1-c1ccc(C(C)C)cc1
InChIInChI=1S/C20H21NO5S/c1-11(2)13-5-7-14(8-6-13)17-12(3)27-19(18(17)20(25)26-4)21-15(22)9-10-16(23)24/h5-11H,1-4H3,(H,21,22)(H,23,24)
InChIKeyKNWCZRXQURNYDN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[3-methoxycarbonyl-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-4-oxo-2-butenoic acid (CHEBI:121472) is a monoterpenoid (CHEBI:25409)
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LSM-32915LINCS