0YG
Summary
| Name: | N-[(2Z)-2-amino-3-(4-hydroxyphenyl)prop-2-enoyl]glycine |
| Formula: | C11 H12 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 236.224 Da |
| Component type: | L-peptide NH3 amino terminus |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | 2-[[(Z)-2-azanyl-3-(4-hydroxyphenyl)prop-2-enoyl]amino]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | NC(=C\c1ccc(O)cc1)/C(=O)NCC(O)=O |
| SMILES | CACTVS | 3.352 | NC(=Cc1ccc(O)cc1)C(=O)NCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1/C=C(/C(=O)NCC(=O)O)\N)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1C=C(C(=O)NCC(=O)O)N)O |
| InChI | InChI | 1.03 | InChI=1S/C11H12N2O4/c12-9(11(17)13-6-10(15)16)5-7-1-3-8(14)4-2-7/h1-5,14H,6,12H2,(H,13,17)(H,15,16)/b9-5- |
| InChIKey | InChI | 1.03 | LQVABVRJNRHIKV-UITAMQMPSA-N |
