Z01
Summary
| Name: | 3-[(2,2-dimethylpropanoyl)amino]-L-alanine |
| Formula: | C8 H16 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 188.224 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[(2,2-dimethylpropanoyl)amino]-L-alanine |
| OpenEye OEToolkits | 1.7.0 | (2S)-2-azanyl-3-(2,2-dimethylpropanoylamino)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCC(N)C(=O)O)C(C)(C)C |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)(C)C(=O)NC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.370 | CC(C)(C)C(=O)NC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)(C)C(=O)NC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)(C)C(=O)NCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H16N2O3/c1-8(2,3)7(13)10-4-5(9)6(11)12/h5H,4,9H2,1-3H3,(H,10,13)(H,11,12)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | YGQJWXCFMYPOHQ-YFKPBYRVSA-N |
