MF3
Summary
Name: | 2-AMINO-4-TRIFLUOROMETHYLSULFANYL-BUTYRIC ACID |
Synonyms: | TRIFLUOROMETHIONINE |
Formula: | C5 H8 F3 N O2 S |
Formal charge: | 0 |
Formula weight: | 203.183 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | trifluoro-L-methionine |
OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-4-(trifluoromethylsulfanyl)butanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | FC(F)(F)SCCC(N)C(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CCSC(F)(F)F)C(O)=O |
SMILES | CACTVS | 3.341 | N[CH](CCSC(F)(F)F)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CSC(F)(F)F)[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CSC(F)(F)F)C(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C5H8F3NO2S/c6-5(7,8)12-2-1-3(9)4(10)11/h3H,1-2,9H2,(H,10,11)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | YLJLTSVBCXYTQK-VKHMYHEASA-N |