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CHEBI:105548 - 4-oxo-4-thiophen-2-ylbutanoic acid [2-(ethylamino)-2-oxoethyl] ester

ChEBI IDCHEBI:105548
ChEBI Name4-oxo-4-thiophen-2-ylbutanoic acid [2-(ethylamino)-2-oxoethyl] ester
Stars
DownloadsMolfile
FormulaC12H15NO4S
Net Charge0
Average Mass269.322
Monoisotopic Mass269.07218
SMILESCCNC(=O)COC(=O)CCC(=O)c1cccs1
InChIInChI=1S/C12H15NO4S/c1-2-13-11(15)8-17-12(16)6-5-9(14)10-4-3-7-18-10/h3-4,7H,2,5-6,8H2,1H3,(H,13,15)
InChIKeyCDDQAQPBRRMWHR-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)
4-oxo-4-thiophen-2-ylbutanoic acid [2-(ethylamino)-2-oxoethyl] ester (CHEBI:105548) is a oxo carboxylic acid (CHEBI:25754)
Manual XrefsDatabases
LSM-16911LINCS