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CHEBI:122154 - 1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester

ChEBI IDCHEBI:122154
ChEBI Name1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester
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DownloadsMolfile
FormulaC17H17N3O5S2
Net Charge0
Average Mass407.473
Monoisotopic Mass407.06096
SMILESNC(=O)c1ccsc1NC(=O)COC(=O)C1CCCN1C(=O)c1cccs1
InChIInChI=1S/C17H17N3O5S2/c18-14(22)10-5-8-27-15(10)19-13(21)9-25-17(24)11-3-1-6-20(11)16(23)12-4-2-7-26-12/h2,4-5,7-8,11H,1,3,6,9H2,(H2,18,22)(H,19,21)
InChIKeyPKFPSCYJZUISCT-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester (CHEBI:122154) is a depsipeptide (CHEBI:23643)
Manual XrefsDatabases
LSM-33597LINCS