VLM
Summary
| Name: | VALINYLAMINE |
| Formula: | C5 H12 N2 O |
| Formal charge: | 0 |
| Formula weight: | 116.162 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | L-valinamide |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-methyl-butanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N)C(N)C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C5H12N2O/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H2,7,8)/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | XDEHMKQLKPZERH-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)[C@H](N)C(N)=O |
| SMILES | CACTVS | 3.385 | CC(C)[CH](N)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.5 | CC(C)[C@@H](C(=O)N)N |
| SMILES | OpenEye OEToolkits | 1.7.5 | CC(C)C(C(=O)N)N |
