MKF
Summary
| Name: | (2~{S})-2-azanyl-3-(dimethylcarbamoyloxy)propanoic acid |
| Formula: | C6 H12 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 176.17 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-3-(dimethylcarbamoyloxy)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H12N2O4/c1-8(2)6(11)12-3-4(7)5(9)10/h4H,3,7H2,1-2H3,(H,9,10)/t4-/m0/s1 |
| InChIKey | InChI | 1.06 | YZZSSACJQJKEJY-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)OC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CN(C)C(=O)OC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)OC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C(=O)OCC(C(=O)O)N |
