5MW
Summary
| Name: | (2~{S})-5-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2-azanyl-pentanoic acid |
| Formula: | C8 H15 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 213.237 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | (2~{S})-5-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2-azanyl-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H15N5O2/c9-4-6-5-13(12-11-6)3-1-2-7(10)8(14)15/h5,7H,1-4,9-10H2,(H,14,15)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | STKLNEOQJAUXGX-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1cn(CCC[C@H](N)C(O)=O)nn1 |
| SMILES | CACTVS | 3.385 | NCc1cn(CCC[CH](N)C(O)=O)nn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1c(nnn1CCC[C@@H](C(=O)O)N)CN |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1c(nnn1CCCC(C(=O)O)N)CN |
