LHV
Summary
| Name: | (2S)-2-hydroxy-3-methylbutanoic acid |
| Formula: | C5 H10 O3 |
| Formal charge: | 0 |
| Formula weight: | 118.131 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-2-hydroxy-3-methylbutanoic acid |
| OpenEye OEToolkits | 1.7.6 | (2S)-3-methyl-2-oxidanyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(O)C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | NGEWQZIDQIYUNV-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)[C@H](O)C(O)=O |
| SMILES | CACTVS | 3.370 | CC(C)[CH](O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)[C@@H](C(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)C(C(=O)O)O |
