FBE
Summary
| Name: | (3E)-5-aminopent-3-enoic acid |
| Formula: | C5 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 115.13 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3E)-5-aminopent-3-enoic acid |
| OpenEye OEToolkits | 1.7.0 | (E)-5-azanylpent-3-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C/C=C/CN |
| SMILES_CANONICAL | CACTVS | 3.370 | NC/C=C/CC(O)=O |
| SMILES | CACTVS | 3.370 | NCC=CCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(/C=C/CN)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(C=CCN)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H9NO2/c6-4-2-1-3-5(7)8/h1-2H,3-4,6H2,(H,7,8)/b2-1+ |
| InChIKey | InChI | 1.03 | IACMVGAGEKETDA-OWOJBTEDSA-N |
