Summary
| Name: | TERT-BUTYLALANINE |
| Formula: | C6 H13 N O2 |
| Formal charge: | 0 |
| Formula weight: | 131.173 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-methyl-L-valine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3,3-dimethyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)C(C)(C)C |
| InChI | InChI | 1.02b | InChI=1/C6H13NO2/c1-6(2,3)4(7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t4-/m1/s1/f/h8H |
| InChIKey | InChI | 1.02b | NPDBDJFLKKQMCM-SGLXVXOJDZ |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)(C)[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.341 | CC(C)(C)[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)(C)[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)(C)C(C(=O)O)N |
