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CHEBI:116354 - 6-[[(2-methoxycarbonyl-3-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid

ChEBI IDCHEBI:116354
ChEBI Name6-[[(2-methoxycarbonyl-3-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid
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DownloadsMolfile
FormulaC14H15NO5S
Net Charge0
Average Mass309.343
Monoisotopic Mass309.06709
SMILESCOC(=O)c1sccc1NC(=O)C1CC=CCC1C(=O)O
InChIInChI=1S/C14H15NO5S/c1-20-14(19)11-10(6-7-21-11)15-12(16)8-4-2-3-5-9(8)13(17)18/h2-3,6-9H,4-5H2,1H3,(H,15,16)(H,17,18)
InChIKeyNCLPSSAAUMRJND-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)
6-[[(2-methoxycarbonyl-3-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid (CHEBI:116354) is a thiophenecarboxylic acid (CHEBI:48436)
Manual XrefsDatabases
LSM-27808LINCS