A1D5B
Summary
| Name: | methyl (2~{S})-2,6-bis(azanyl)hexanoate |
| Synonyms: | Methyl lysinate |
| Formula: | C7 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 160.214 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl (2~{S})-2,6-bis(azanyl)hexanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H16N2O2/c1-11-7(10)6(9)4-2-3-5-8/h6H,2-5,8-9H2,1H3/t6-/m0/s1 |
| InChIKey | InChI | 1.06 | KPNBUPJZFJCCIQ-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)[C@@H](N)CCCCN |
| SMILES | CACTVS | 3.385 | COC(=O)[CH](N)CCCCN |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)[C@H](CCCCN)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)C(CCCCN)N |
