EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H20N4O5 |
| Net Charge | 0 |
| Average Mass | 384.392 |
| Monoisotopic Mass | 384.14337 |
| SMILES | COc1ccc(CNC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)o2)cc1 |
| InChI | InChI=1S/C19H20N4O5/c1-12-18(23(25)26)13(2)22(21-12)11-16-8-9-17(28-16)19(24)20-10-14-4-6-15(27-3)7-5-14/h4-9H,10-11H2,1-3H3,(H,20,24) |
| InChIKey | YZMHCMFLUHZCAB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[(4-methoxyphenyl)methyl]-2-furancarboxamide (CHEBI:105328) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16691 | LINCS |