AS2
Summary
| Name: | (2R)-2-AMINO-4-OXOBUTANOIC ACID |
| Synonyms: | ASPARTATE SEMIALDEHYDE |
| Formula: | C4 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 117.103 Da |
| Component type: | D-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R)-2-amino-4-oxobutanoic acid |
| OpenEye OEToolkits | 1.5.0 | (2R)-2-amino-4-oxo-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=CCC(N)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@H](CC=O)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](CC=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C=O)[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C=O)C(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C4H7NO3/c5-3(1-2-6)4(7)8/h2-3H,1,5H2,(H,7,8)/t3-/m1/s1 |
| InChIKey | InChI | 1.03 | HOSWPDPVFBCLSY-GSVOUGTGSA-N |
