KR3
Summary
| Name: | N~6~-(ethoxycarbonyl)-L-lysine |
| Formula: | C9 H18 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 218.25 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-(ethoxycarbonyl)-L-lysine |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-6-(ethoxycarbonylamino)hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCCCCC(N)C(=O)O)OCC |
| InChI | InChI | 1.03 | InChI=1S/C9H18N2O4/c1-2-15-9(14)11-6-4-3-5-7(10)8(12)13/h7H,2-6,10H2,1H3,(H,11,14)(H,12,13)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | XMVZHEKLZHYPQS-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)NCCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CCOC(=O)NCCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)NCCCC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)NCCCCC(C(=O)O)N |
