EZ4
Summary
| Name: | (2S,3R,4R)-2,3,4,5-tetrahydroxy-N-oxo-pentanamide |
| Formula: | C5 H9 N O6 |
| Formal charge: | 0 |
| Formula weight: | 179.128 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S,3R,4R)-2,3,4,5-tetrahydroxy-N-oxopentanamide (non-preferred name) |
| OpenEye OEToolkits | 1.7.0 | (2S,3R,4R)-2,3,4,5-tetrahydroxy-N-oxo-pentanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=NC(=O)C(O)C(O)C(O)CO |
| SMILES_CANONICAL | CACTVS | 3.370 | OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)N=O |
| SMILES | CACTVS | 3.370 | OC[CH](O)[CH](O)[CH](O)C(=O)N=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C([C@H]([C@H]([C@@H](C(=O)N=O)O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(C(C(C(C(=O)N=O)O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H9NO6/c7-1-2(8)3(9)4(10)5(11)6-12/h2-4,7-10H,1H2/t2-,3-,4+/m1/s1 |
| InChIKey | InChI | 1.03 | VIMQVNVKLDVNFU-JJYYJPOSSA-N |
