EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H14N2O6 |
| Net Charge | 0 |
| Average Mass | 378.340 |
| Monoisotopic Mass | 378.08519 |
| SMILES | O=C(NN=Cc1cccc(OC(=O)c2ccco2)c1)c1ccc2c(c1)OCO2 |
| InChI | InChI=1S/C20H14N2O6/c23-19(14-6-7-16-18(10-14)27-12-26-16)22-21-11-13-3-1-4-15(9-13)28-20(24)17-5-2-8-25-17/h1-11H,12H2,(H,22,23) |
| InChIKey | GNYOHTYZOUTCQW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-furancarboxylic acid [3-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]phenyl] ester (CHEBI:121267) is a benzoate ester (CHEBI:36054) |
| 2-furancarboxylic acid [3-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]phenyl] ester (CHEBI:121267) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32710 | LINCS |