3ZL
Summary
| Name: | N~6~-[(1Z)-4-amino-3-oxopenta-1,4-dien-1-yl]-L-lysine |
| Formula: | C11 H19 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 241.287 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-[(1Z)-4-amino-3-oxopenta-1,4-dien-1-yl]-L-lysine |
| OpenEye OEToolkits | 1.9.2 | (2S)-2-azanyl-6-[[(1Z)-4-azanyl-3-oxidanylidene-penta-1,4-dienyl]amino]hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CCCCN/C=C\C(=O)C(=C)/N |
| InChI | InChI | 1.03 | InChI=1S/C11H19N3O3/c1-8(12)10(15)5-7-14-6-3-2-4-9(13)11(16)17/h5,7,9,14H,1-4,6,12-13H2,(H,16,17)/b7-5-/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | HDSUFAZLYUUHFR-PGBBXKAQSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CCCCN\C=C/C(=O)C(N)=C)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CCCCNC=CC(=O)C(N)=C)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C=C(C(=O)/C=C\NCCCC[C@@H](C(=O)O)N)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | C=C(C(=O)C=CNCCCCC(C(=O)O)N)N |
