A1D8R
Summary
| Name: | (2~{S})-2,4-bis(azanyl)-3,3-dimethyl-butanoic acid |
| Formula: | C6 H14 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 146.188 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2,4-bis(azanyl)-3,3-dimethyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H14N2O2/c1-6(2,3-7)4(8)5(9)10/h4H,3,7-8H2,1-2H3,(H,9,10)/t4-/m1/s1 |
| InChIKey | InChI | 1.06 | CCTPBLHNQLRMPA-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(CN)[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(C)(CN)[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(CN)[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(CN)C(C(=O)O)N |
