UEI
Summary
| Name: | (2R,3S)-3-methyl-2-oxidanyl-pentanoic acid |
| Synonyms: | (2R,3S)-2-hydroxy-3-methylpentanoic acid |
| Formula: | C6 H12 O3 |
| Formal charge: | 0 |
| Formula weight: | 132.158 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R},3~{S})-3-methyl-2-oxidanyl-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5+/m0/s1 |
| InChIKey | InChI | 1.06 | RILPIWOPNGRASR-CRCLSJGQSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@H](C)[C@@H](O)C(O)=O |
| SMILES | CACTVS | 3.385 | CC[CH](C)[CH](O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC[C@H](C)[C@H](C(=O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(C)C(C(=O)O)O |
