YHA
Summary
| Name: | Homocitrulline |
| Synonyms: | N~6~-carbamoyl-L-lysine |
| Formula: | C7 H15 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 189.212 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~6~-carbamoyl-L-lysine |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-6-(aminocarbonylamino)-2-azanyl-hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(CCCCNC(N)=O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C7H15N3O3/c8-5(6(11)12)3-1-2-4-10-7(9)13/h5H,1-4,8H2,(H,11,12)(H3,9,10,13)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | XIGSAGMEBXLVJJ-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CCCCNC(N)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CCCCNC(N)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(CCNC(=O)N)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(CCNC(=O)N)CC(C(=O)O)N |
