FBE
(3E)-5-aminopent-3-enoic acid
| Created: | 1999-07-08 |
| Last modified: | 2024-09-27 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 17 |
| Chiral Atom Count | 0 |
| Bond Count | 16 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | (3E)-5-aminopent-3-enoic acid |
| Systematic Name (OpenEye OEToolkits) | (E)-5-azanylpent-3-enoic acid |
| Formula | C5 H9 N O2 |
| Molecular Weight | 115.13 |
| Type | PEPTIDE-LIKE |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C/C=C/CN |
| SMILES | CACTVS | 3.370 | NCC=CCC(O)=O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(C=CCN)C(=O)O |
| Canonical SMILES | CACTVS | 3.370 | NC/C=C/CC(O)=O |
| Canonical SMILES | OpenEye OEToolkits | 1.7.0 | C(/C=C/CN)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 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 13572516 |














