5XB
Summary
| Name: | (2~{R},4~{R})-1,3-thiazolidine-2,4-dicarboxylic acid |
| Formula: | C5 H7 N O4 S |
| Formal charge: | 0 |
| Formula weight: | 177.178 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | (2~{R},4~{R})-1,3-thiazolidine-2,4-dicarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H7NO4S/c7-4(8)2-1-11-3(6-2)5(9)10/h2-3,6H,1H2,(H,7,8)(H,9,10)/t2-,3+/m0/s1 |
| InChIKey | InChI | 1.03 | DAXBISKSIDBYEU-STHAYSLISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@@H]1CS[C@@H](N1)C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)[CH]1CS[CH](N1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C1[C@H](N[C@H](S1)C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | C1C(NC(S1)C(=O)O)C(=O)O |
