FGL
Summary
| Name: | 2-AMINOPROPANEDIOIC ACID |
| Formula: | C3 H5 N O4 |
| Formal charge: | 0 |
| Formula weight: | 119.076 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | aminopropanedioic acid |
| OpenEye OEToolkits | 1.5.0 | 2-aminopropanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(C(O)=O)C(O)=O |
| SMILES | CACTVS | 3.341 | NC(C(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C(=O)O)(C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(=O)O)(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C3H5NO4/c4-1(2(5)6)3(7)8/h1H,4H2,(H,5,6)(H,7,8) |
| InChIKey | InChI | 1.03 | JINBYESILADKFW-UHFFFAOYSA-N |
