9E7
Summary
| Name: | N~6~-(sulfanylmethyl)-L-lysine |
| Formula: | C7 H16 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 192.279 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-(sulfanylmethyl)-L-lysine |
| OpenEye OEToolkits | 2.0.6 | (2~{S})-2-azanyl-6-(sulfanylmethylamino)hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(O)(C(N)CCCCNCS)=O |
| InChI | InChI | 1.03 | InChI=1S/C7H16N2O2S/c8-6(7(10)11)3-1-2-4-9-5-12/h6,9,12H,1-5,8H2,(H,10,11)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | IEEWMGZMRLQVDH-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CCCCNCS)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CCCCNCS)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C(CCNCS)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | C(CCNCS)CC(C(=O)O)N |
