VAL
Summary
| Name: | VALINE |
| Formula: | C5 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 117.146 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | L-valine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-methyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)C(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.341 | CC(C)[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)C(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | KZSNJWFQEVHDMF-BYPYZUCNSA-N |
