35Y
Summary
| Name: | 3-[(1H-tetrazol-5-ylcarbonyl)amino]-L-alanine |
| Formula: | C5 H8 N6 O3 |
| Formal charge: | 0 |
| Formula weight: | 200.155 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[(1H-tetrazol-5-ylcarbonyl)amino]-L-alanine |
| OpenEye OEToolkits | 1.7.0 | (2S)-2-azanyl-3-(1H-1,2,3,4-tetrazol-5-ylcarbonylamino)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCC(C(=O)O)N)c1nnnn1 |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CNC(=O)c1[nH]nnn1)C(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](CNC(=O)c1[nH]nnn1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C([C@@H](C(=O)O)N)NC(=O)c1[nH]nnn1 |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(C(C(=O)O)N)NC(=O)c1[nH]nnn1 |
| InChI | InChI | 1.03 | InChI=1S/C5H8N6O3/c6-2(5(13)14)1-7-4(12)3-8-10-11-9-3/h2H,1,6H2,(H,7,12)(H,13,14)(H,8,9,10,11)/t2-/m0/s1 |
| InChIKey | InChI | 1.03 | ULFSZHXWLBPMTO-REOHCLBHSA-N |
