0A0
Summary
| Name: | 2-methyl-L-aspartic acid |
| Formula: | C5 H9 N O4 |
| Formal charge: | 0 |
| Formula weight: | 147.129 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-methyl-L-aspartic acid |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-2-methyl-butanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CC(N)(C(=O)O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@](N)(CC(O)=O)C(O)=O |
| SMILES | CACTVS | 3.341 | C[C](N)(CC(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@](CC(=O)O)(C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(CC(=O)O)(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H9NO4/c1-5(6,4(9)10)2-3(7)8/h2,6H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | CWAYDJFPMMUKOI-YFKPBYRVSA-N |
