CMA
Summary
| Name: | N2-(CARBOXYETHYL)-L-ARGININE |
| Formula: | C9 H18 N4 O4 |
| Formal charge: | 0 |
| Formula weight: | 246.264 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N~2~-(2-carboxyethyl)-L-arginine |
| OpenEye OEToolkits | 1.5.0 | (2S)-5-carbamimidamido-2-(2-carboxyethylamino)pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCNC(C(=O)O)CCCNC(=[N@H])N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=N)NCCC[C@H](NCCC(O)=O)C(O)=O |
| SMILES | CACTVS | 3.341 | NC(=N)NCCC[CH](NCCC(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C[C@@H](C(=O)O)NCCC(=O)O)CNC(=N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CC(C(=O)O)NCCC(=O)O)CNC(=N)N |
| InChI | InChI | 1.03 | InChI=1S/C9H18N4O4/c10-9(11)13-4-1-2-6(8(16)17)12-5-3-7(14)15/h6,12H,1-5H2,(H,14,15)(H,16,17)(H4,10,11,13)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | OHWCFZJEIHZWMN-LURJTMIESA-N |
