5OL
Summary
| Name: | N~6~-(1,1-dihydroxyethyl)-L-lysine |
| Formula: | C8 H18 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 206.24 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-(1,1-dihydroxyethyl)-L-lysine |
| OpenEye OEToolkits | 2.0.4 | (2~{S})-2-azanyl-6-[1,1-bis(oxidanyl)ethylamino]hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(CCCCNC(C)(O)O)(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H18N2O4/c1-8(13,14)10-5-3-2-4-6(9)7(11)12/h6,10,13-14H,2-5,9H2,1H3,(H,11,12)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | VPMDIAZXPVLBIV-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(O)(O)NCCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(O)(O)NCCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CC(NCCCC[C@@H](C(=O)O)N)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC(NCCCCC(C(=O)O)N)(O)O |
