TEF
Summary
| Name: | 4-(2H-tetrazol-2-yl)-L-phenylalanine |
| Synonyms: | p-(2-tetrazolyl)-phenylalanine |
| Formula: | C10 H11 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 233.227 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(2H-tetrazol-2-yl)-L-phenylalanine |
| OpenEye OEToolkits | 1.7.0 | (2S)-2-azanyl-3-[4-(1,2,3,4-tetrazol-2-yl)phenyl]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)Cc1ccc(cc1)n2ncnn2 |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](Cc1ccc(cc1)n2ncnn2)C(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](Cc1ccc(cc1)n2ncnn2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1C[C@@H](C(=O)O)N)n2ncnn2 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1CC(C(=O)O)N)n2ncnn2 |
| InChI | InChI | 1.03 | InChI=1S/C10H11N5O2/c11-9(10(16)17)5-7-1-3-8(4-2-7)15-13-6-12-14-15/h1-4,6,9H,5,11H2,(H,16,17)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | KHTQUIIGXJUWFB-VIFPVBQESA-N |
