A1ADO
Summary
| Name: | (4R)-5-fluoro-L-leucine |
| Formula: | C6 H12 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 149.163 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4R)-5-fluoro-L-leucine |
| OpenEye OEToolkits | 2.0.7 | (2~{S},4~{R})-2-azanyl-5-fluoranyl-4-methyl-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | FCC(C)CC(N)C(=O)O |
| InChI | InChI | 1.06 | InChI=1S/C6H12FNO2/c1-4(3-7)2-5(8)6(9)10/h4-5H,2-3,8H2,1H3,(H,9,10)/t4-,5+/m1/s1 |
| InChIKey | InChI | 1.06 | FHOARJRQRXAPOF-UHNVWZDZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](CF)C[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | C[CH](CF)C[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](C[C@@H](C(=O)O)N)CF |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(CC(C(=O)O)N)CF |
