AR5
Summary
| Name: | N~2~-(tert-butoxycarbonyl)-L-arginine |
| Formula: | C11 H22 N4 O4 |
| Formal charge: | 0 |
| Formula weight: | 274.317 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~2~-(tert-butoxycarbonyl)-L-arginine |
| OpenEye OEToolkits | 2.0.4 | (2~{S})-5-carbamimidamido-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NC(CCCN\C(=N)N)C(=O)O)OC(C)(C)C |
| InChI | InChI | 1.03 | InChI=1S/C11H22N4O4/c1-11(2,3)19-10(18)15-7(8(16)17)5-4-6-14-9(12)13/h7H,4-6H2,1-3H3,(H,15,18)(H,16,17)(H4,12,13,14)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | HSQIYOPBCOPMSS-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=N)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(C)(C)OC(=O)N[CH](CCCNC(N)=N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | [H]/N=C(/N)\NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC(C)(C)OC(=O)NC(CCCNC(=N)N)C(=O)O |
