FLE
Summary
| Name: | FUROYL-LEUCINE |
| Formula: | C11 H15 N O4 |
| Formal charge: | 0 |
| Formula weight: | 225.241 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(furan-2-ylcarbonyl)-L-leucine |
| OpenEye OEToolkits | 1.7.0 | (2S)-2-(furan-2-ylcarbonylamino)-4-methyl-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NC(C(=O)O)CC(C)C)c1occc1 |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)C[C@H](NC(=O)c1occc1)C(O)=O |
| SMILES | CACTVS | 3.370 | CC(C)C[CH](NC(=O)c1occc1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)C[C@@H](C(=O)O)NC(=O)c1ccco1 |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)CC(C(=O)O)NC(=O)c1ccco1 |
| InChI | InChI | 1.03 | InChI=1S/C11H15NO4/c1-7(2)6-8(11(14)15)12-10(13)9-4-3-5-16-9/h3-5,7-8H,6H2,1-2H3,(H,12,13)(H,14,15)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | LXBURZIESWDWIV-QMMMGPOBSA-N |
