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CHEBI:112906 - 2-[[2-[(ethoxycarbonylamino)-oxomethyl]-3-oxobut-1-enyl]amino]-3-thiophenecarboxylic acid methyl ester

ChEBI IDCHEBI:112906
ChEBI Name2-[[2-[(ethoxycarbonylamino)-oxomethyl]-3-oxobut-1-enyl]amino]-3-thiophenecarboxylic acid methyl ester
Stars
DownloadsMolfile
FormulaC14H16N2O6S
Net Charge0
Average Mass340.357
Monoisotopic Mass340.07291
SMILESCCOC(=O)NC(=O)C(=CNc1sccc1C(=O)OC)C(C)=O
InChIInChI=1S/C14H16N2O6S/c1-4-22-14(20)16-11(18)10(8(2)17)7-15-12-9(5-6-23-12)13(19)21-3/h5-7,15H,4H2,1-3H3,(H,16,18,20)
InChIKeyAYOZRXOYDTUEAA-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[[2-[(ethoxycarbonylamino)-oxomethyl]-3-oxobut-1-enyl]amino]-3-thiophenecarboxylic acid methyl ester (CHEBI:112906) is a thiophenecarboxylic acid (CHEBI:48436)
Manual XrefsDatabases
LSM-24316LINCS