4FO
Summary
| Name: | (2R)-2,4-diaminobutanoic acid |
| Formula: | C4 H10 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 118.134 Da |
| Component type: | D-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2,4-diaminobutanoic acid |
| OpenEye OEToolkits | 1.7.6 | (2R)-2,4-bis(azanyl)butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(CCN)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H10N2O2/c5-2-1-3(6)4(7)8/h3H,1-2,5-6H2,(H,7,8)/t3-/m1/s1 |
| InChIKey | InChI | 1.03 | OGNSCSPNOLGXSM-GSVOUGTGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCC[C@@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | NCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(CN)[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CN)C(C(=O)O)N |
