4FB
Summary
| Name: | (4S)-4-FLUORO-L-PROLINE |
| Formula: | C5 H8 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 133.121 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (4S)-4-fluoro-L-proline |
| OpenEye OEToolkits | 1.5.0 | (2S,4S)-4-fluoropyrrolidine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C1NCC(F)C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)[C@@H]1C[C@H](F)CN1 |
| SMILES | CACTVS | 3.341 | OC(=O)[CH]1C[CH](F)CN1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@@H](CN[C@@H]1C(=O)O)F |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1C(CNC1C(=O)O)F |
| InChI | InChI | 1.03 | InChI=1S/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4-/m0/s1 |
| InChIKey | InChI | 1.03 | ZIWHMENIDGOELV-IMJSIDKUSA-N |
