CHEBI:92782 - 4-[5-amino-3-methyl-4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-thiophenyl]butanoic acid

ChEBI IDCHEBI:92782
ChEBI Name4-[5-amino-3-methyl-4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-thiophenyl]butanoic acid
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FormulaC17H16F3NO3S
Net Charge0
Average Mass371.380
Monoisotopic Mass371.08030
SMILESCc1c(CCCC(=O)O)sc(N)c1C(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C17H16F3NO3S/c1-9-12(6-3-7-13(22)23)25-16(21)14(9)15(24)10-4-2-5-11(8-10)17(18,19)20/h2,4-5,8H,3,6-7,21H2,1H3,(H,22,23)
InChIKeyVKIOQVZNZFRNDU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[5-amino-3-methyl-4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-thiophenyl]butanoic acid (CHEBI:92782) is a thiophenes (CHEBI:26961)
Manual XrefsDatabases
LSM-2984LINCS