DBU
Summary
| Name: | (2Z)-2-AMINOBUT-2-ENOIC ACID |
| Synonyms: | Z-DEHYDROBUTYRINE |
| Formula: | C4 H7 N O2 |
| Formal charge: | 0 |
| Formula weight: | 101.104 Da |
| Component type: | PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2Z)-2-aminobut-2-enoic acid |
| OpenEye OEToolkits | 1.5.0 | (Z)-2-aminobut-2-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(=C/C)/N |
| SMILES_CANONICAL | CACTVS | 3.341 | C\C=C(/N)C(O)=O |
| SMILES | CACTVS | 3.341 | CC=C(N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C\C=C(\C(=O)O)/N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC=C(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C4H7NO2/c1-2-3(5)4(6)7/h2H,5H2,1H3,(H,6,7)/b3-2- |
| InChIKey | InChI | 1.03 | PAWSVPVNIXFKOS-IHWYPQMZSA-N |
