UKM
Summary
| Name: | (1R)-1-hydroxybutane-1-sulfonic acid |
| Formula: | C4 H10 O4 S |
| Formal charge: | 0 |
| Formula weight: | 154.185 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-1-hydroxybutane-1-sulfonic acid |
| OpenEye OEToolkits | 2.0.7 | (1~{R})-1-oxidanylbutane-1-sulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(CCC)(O)S(=O)(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C4H10O4S/c1-2-3-4(5)9(6,7)8/h4-5H,2-3H2,1H3,(H,6,7,8)/t4-/m1/s1 |
| InChIKey | InChI | 1.03 | KMBRJVMBQNMRDM-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC[C@H](O)[S](O)(=O)=O |
| SMILES | CACTVS | 3.385 | CCC[CH](O)[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC[C@H](O)S(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCC(O)S(=O)(=O)O |
