2YH
Summary
| Name: | N~5~-D-ornithyl-L-ornithine |
| Formula: | C10 H22 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 246.307 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~5~-D-ornithyl-L-ornithine |
| OpenEye OEToolkits | 1.7.6 | (2S)-2-azanyl-5-[[(2R)-2,5-bis(azanyl)pentanoyl]amino]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CCCNC(=O)C(N)CCCN |
| InChI | InChI | 1.03 | InChI=1S/C10H22N4O3/c11-5-1-3-7(12)9(15)14-6-2-4-8(13)10(16)17/h7-8H,1-6,11-13H2,(H,14,15)(H,16,17)/t7-,8+/m1/s1 |
| InChIKey | InChI | 1.03 | MCMLHDBHZRLOED-SFYZADRCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCC[C@@H](N)C(=O)NCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | NCCC[CH](N)C(=O)NCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(C[C@H](C(=O)NCCC[C@@H](C(=O)O)N)N)CN |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CC(C(=O)NCCCC(C(=O)O)N)N)CN |
