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CHEBI:78014 - 5,5,5-trifluoroleucine

ChEBI IDCHEBI:78014
ChEBI Name5,5,5-trifluoroleucine
Stars
DefinitionA leucine derivative in which one of its methyl groups is replaced by trifluoromethyl.
Last Modified16 December 2014
SubmitterSteve
DownloadsMolfile
FormulaC6H10F3NO2
Net Charge0
Average Mass185.145
Monoisotopic Mass185.06636
SMILESCC(CC(N)C(=O)O)C(F)(F)F
InChIInChI=1S/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)
InChIKeyXFGVJLGVINCWDP-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5,5,5-trifluoroleucine (CHEBI:78014) has functional parent leucine (CHEBI:25017)
5,5,5-trifluoroleucine (CHEBI:78014) is a leucine derivative (CHEBI:47003)
5,5,5-trifluoroleucine (CHEBI:78014) is a non-proteinogenic α-amino acid (CHEBI:83925)
5,5,5-trifluoroleucine (CHEBI:78014) is a organofluorine compound (CHEBI:37143)
IUPAC Name 
5,5,5-trifluoroleucine
Synonyms  Source
5,5,5-Trifluoro-DL-leucineChemIDplus
DL-5',5',5'-TrifluoroleucineChemIDplus
TrifluoroleucineChemIDplus
5',5',5'-TrifluoroleucineChemIDplus
Registry NumbersSources
Reaxys:1707901Reaxys
CAS:2792-72-5ChemIDplus
Citations