POM
Summary
| Name: | CIS-5-METHYL-4-OXOPROLINE |
| Formula: | C6 H9 N O3 |
| Formal charge: | 0 |
| Formula weight: | 143.141 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (5S)-5-methyl-4-oxo-L-proline |
| OpenEye OEToolkits | 1.5.0 | (2S,5S)-5-methyl-4-oxo-pyrrolidine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C(NC(C(=O)O)C1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H]1N[C@@H](CC1=O)C(O)=O |
| SMILES | CACTVS | 3.341 | C[CH]1N[CH](CC1=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H]1C(=O)C[C@H](N1)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1C(=O)CC(N1)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H9NO3/c1-3-5(8)2-4(7-3)6(9)10/h3-4,7H,2H2,1H3,(H,9,10)/t3-,4-/m0/s1 |
| InChIKey | InChI | 1.03 | QQBMOLVYWYXMIA-IMJSIDKUSA-N |
