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CHEBI:119919 - 4-[[3-[(2-methoxyanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid

ChEBI IDCHEBI:119919
ChEBI Name4-[[3-[(2-methoxyanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid
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DownloadsMolfile
FormulaC21H24N2O5S
Net Charge0
Average Mass416.499
Monoisotopic Mass416.14059
SMILESCOc1ccccc1NC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCCCC2
InChIInChI=1S/C21H24N2O5S/c1-28-15-9-6-5-8-14(15)22-20(27)19-13-7-3-2-4-10-16(13)29-21(19)23-17(24)11-12-18(25)26/h5-6,8-9H,2-4,7,10-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)
InChIKeyDFGDSWGIYUFWQJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[3-[(2-methoxyanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid (CHEBI:119919) is a aromatic amide (CHEBI:62733)
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