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CHEBI:115465 - 2-[[2-(cyclohexylamino)-2-oxo-1-thiophen-2-ylethyl]-[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]acetic acid ethyl ester

ChEBI IDCHEBI:115465
ChEBI Name2-[[2-(cyclohexylamino)-2-oxo-1-thiophen-2-ylethyl]-[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]acetic acid ethyl ester
Stars
DownloadsMolfile
FormulaC23H29N3O5S2
Net Charge0
Average Mass491.635
Monoisotopic Mass491.15486
SMILESCCOC(=O)CN(C(=O)CNC(=O)c1cccs1)C(C(=O)NC1CCCCC1)c1cccs1
InChIInChI=1S/C23H29N3O5S2/c1-2-31-20(28)15-26(19(27)14-24-22(29)18-11-7-13-33-18)21(17-10-6-12-32-17)23(30)25-16-8-4-3-5-9-16/h6-7,10-13,16,21H,2-5,8-9,14-15H2,1H3,(H,24,29)(H,25,30)
InChIKeyJQGGJWOZKVGIAX-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)
2-[[2-(cyclohexylamino)-2-oxo-1-thiophen-2-ylethyl]-[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]acetic acid ethyl ester (CHEBI:115465) is a peptide (CHEBI:16670)
Manual XrefsDatabases
LSM-26922LINCS