5XU
Summary
| Name: | (2~{S})-2-azanylpropanal |
| Synonyms: | Ala-aldehyde |
| Formula: | C3 H7 N O |
| Formal charge: | 0 |
| Formula weight: | 73.094 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | (2~{S})-2-azanylpropanal |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C3H7NO/c1-3(4)2-5/h2-3H,4H2,1H3/t3-/m0/s1 |
| InChIKey | InChI | 1.03 | QPMCUNAXNMSGTK-VKHMYHEASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](N)C=O |
| SMILES | CACTVS | 3.385 | C[CH](N)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C[C@@H](C=O)N |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC(C=O)N |
