HOO
Summary
| Name: | (2~{S})-2-azanyl-3-[2,5-bis(oxidanylidene)imidazol-4-yl]propanoic acid |
| Formula: | C6 H7 N3 O4 |
| Formal charge: | 0 |
| Formula weight: | 185.137 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{S})-2-azanyl-3-[2,5-bis(oxidanylidene)imidazol-4-yl]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H7N3O4/c7-2(5(11)12)1-3-4(10)9-6(13)8-3/h2H,1,7H2,(H,11,12)(H,9,10,13)/t2-/m0/s1 |
| InChIKey | InChI | 1.03 | HQYOJZBTFAOZED-REOHCLBHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CC1=NC(=O)NC1=O)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CC1=NC(=O)NC1=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C(C1=NC(=O)NC1=O)[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | C(C1=NC(=O)NC1=O)C(C(=O)O)N |
