EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:109372 - 2-[1-[2-oxo-2-[(4-thiophen-2-ylphenyl)methylamino]ethyl]cyclohexyl]acetic acid

ChEBI IDCHEBI:109372
ChEBI Name2-[1-[2-oxo-2-[(4-thiophen-2-ylphenyl)methylamino]ethyl]cyclohexyl]acetic acid
Stars
DownloadsMolfile
FormulaC21H25NO3S
Net Charge0
Average Mass371.502
Monoisotopic Mass371.15551
SMILESO=C(O)CC1(CC(=O)NCc2ccc(-c3cccs3)cc2)CCCCC1
InChIInChI=1S/C21H25NO3S/c23-19(13-21(14-20(24)25)10-2-1-3-11-21)22-15-16-6-8-17(9-7-16)18-5-4-12-26-18/h4-9,12H,1-3,10-11,13-15H2,(H,22,23)(H,24,25)
InChIKeyXNTWJMJXMUOEAK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[1-[2-oxo-2-[(4-thiophen-2-ylphenyl)methylamino]ethyl]cyclohexyl]acetic acid (CHEBI:109372) is a benzenes (CHEBI:22712)
Manual XrefsDatabases
LSM-20770LINCS