08M
Summary
| Name: | N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine |
| Formula: | C10 H14 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 238.243 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine |
| OpenEye OEToolkits | 1.7.6 | (2S)-2-azanyl-5-(pyrazin-2-ylcarbonylamino)pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCCCC(C(=O)O)N)c1nccnc1 |
| InChI | InChI | 1.03 | InChI=1S/C10H14N4O3/c11-7(10(16)17)2-1-3-14-9(15)8-6-12-4-5-13-8/h4-7H,1-3,11H2,(H,14,15)(H,16,17)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | GJGIGJGNECGMMN-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CCCNC(=O)c1cnccn1)C(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](CCCNC(=O)c1cnccn1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cnc(cn1)C(=O)NCCC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cnc(cn1)C(=O)NCCCC(C(=O)O)N |
