5GG
Summary
| Name: | Deoxyhypusine |
| Formula: | C10 H23 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 217.309 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-(4-aminobutyl)-L-lysine |
| OpenEye OEToolkits | 1.9.2 | (2S)-2-azanyl-6-(4-azanylbutylamino)hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(C(=O)O)CCCCNCCCCN |
| InChI | InChI | 1.03 | InChI=1S/C10H23N3O2/c11-6-2-4-8-13-7-3-1-5-9(12)10(14)15/h9,13H,1-8,11-12H2,(H,14,15)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | PGPFBXMCOQNMJO-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCCCNCCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | NCCCCNCCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C(CCNCCCCN)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(CCNCCCCN)CC(C(=O)O)N |
