MLU
Summary
| Name: | N-methyl-D-leucine |
| Formula: | C7 H15 N O2 |
| Formal charge: | 0 |
| Formula weight: | 145.199 Da |
| Component type: | D-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methyl-D-leucine |
| OpenEye OEToolkits | 1.7.6 | (2R)-4-methyl-2-(methylamino)pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | XJODGRWDFZVTKW-ZCFIWIBFSA-N |
| SMILES | ACDLabs | 12.01 | O=C(O)C(NC)CC(C)C |
| SMILES_CANONICAL | CACTVS | 3.370 | CN[C@H](CC(C)C)C(O)=O |
| SMILES | CACTVS | 3.370 | CN[CH](CC(C)C)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)C[C@H](C(=O)O)NC |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)CC(C(=O)O)NC |
