| PDB CCD ID: | XYG |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C14 H13 N3 O4 |
| InChI: | InChI=1S/C14H13N3O4/c1-8(15)13-16-11(14(21)17(13)7-12(19)20)6-9-2-4-10(18)5-3-9/h2-6,15,18H,7H2,1H3,(H,19,20)/b11-6-,15-8+ |
| InChIKey: | FSJJUXNBJXUIPS-HUYCBWRHSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | CC(=N)C1=N\C(=C/c2ccc(O)cc2)C(=O)N1CC(O)=O | | ACDLabs 10.04 | O=C1C(\N=C(C(=[N@H])C)N1CC(=O)O)=C\c2ccc(O)cc2 | | OpenEye OEToolkits 1.5.0 | [H]/N=C(\C)/C1=N/C(=C\c2ccc(cc2)O)/C(=O)N1CC(=O)O | | CACTVS 3.341 | CC(=N)C1=NC(=Cc2ccc(O)cc2)C(=O)N1CC(O)=O | | OpenEye OEToolkits 1.5.0 | [H]N=C(C)C1=NC(=Cc2ccc(cc2)O)C(=O)N1CC(=O)O |
|
| Name: | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID;
CHROMOPHORE (DECARBOXYLATED ASP-TYR-GLY) |
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