2MR
Summary
| Name: | N3, N4-DIMETHYLARGININE |
| Formula: | C8 H18 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 202.254 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N~5~-(N,N'-dimethylcarbamimidoyl)-L-ornithine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-5-[(N,N'-dimethylcarbamimidoyl)amino]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)CCCN\C(=N/C)NC |
| SMILES_CANONICAL | CACTVS | 3.341 | CNC(NCCC[C@H](N)C(O)=O)=NC |
| SMILES | CACTVS | 3.341 | CNC(NCCC[CH](N)C(O)=O)=NC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN/C(=N/C)/NCCC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CNC(=NC)NCCCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H18N4O2/c1-10-8(11-2)12-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H,13,14)(H2,10,11,12)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | HVPFXCBJHIIJGS-LURJTMIESA-N |
