2ML
Summary
| Name: | 2-METHYLLEUCINE |
| Formula: | C7 H15 N O2 |
| Formal charge: | 0 |
| Formula weight: | 145.199 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-methyl-L-leucine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-2,4-dimethyl-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)(C)CC(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)C[C@](C)(N)C(O)=O |
| SMILES | CACTVS | 3.341 | CC(C)C[C](C)(N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)C[C@@](C)(C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)CC(C)(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C7H15NO2/c1-5(2)4-7(3,8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | ARSWQPLPYROOBG-ZETCQYMHSA-N |
