2YJ
Summary
| Name: | N~5~-D-lysyl-L-ornithine |
| Formula: | C11 H24 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 260.333 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~5~-D-lysyl-L-ornithine |
| OpenEye OEToolkits | 1.7.6 | (2S)-2-azanyl-5-[[(2R)-2,6-bis(azanyl)hexanoyl]amino]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CCCNC(=O)C(N)CCCCN |
| InChI | InChI | 1.03 | InChI=1S/C11H24N4O3/c12-6-2-1-4-8(13)10(16)15-7-3-5-9(14)11(17)18/h8-9H,1-7,12-14H2,(H,15,16)(H,17,18)/t8-,9+/m1/s1 |
| InChIKey | InChI | 1.03 | IIZZYHGWMHUAMZ-BDAKNGLRSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCCC[C@@H](N)C(=O)NCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | NCCCC[CH](N)C(=O)NCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(CCN)C[C@H](C(=O)NCCC[C@@H](C(=O)O)N)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CCN)CC(C(=O)NCCCC(C(=O)O)N)N |
