EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H20N4O2 |
| Net Charge | 0 |
| Average Mass | 360.417 |
| Monoisotopic Mass | 360.15863 |
| SMILES | COc1ccc(Oc2cccc(Cc3nccn3)c2)c(Cc2nccn2)c1 |
| InChI | InChI=1S/C21H20N4O2/c1-26-17-5-6-19(16(13-17)14-21-24-9-10-25-21)27-18-4-2-3-15(11-18)12-20-22-7-8-23-20/h2-11,13H,12,14H2,1H3,(H,22,23)(H,24,25) |
| InChIKey | GTJSRUGILPIENS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lepidine C (CHEBI:175626) is a aromatic ether (CHEBI:35618) |
| IUPAC Name |
|---|
| 2-[[3-[2-(1H-imidazol-2-ylmethyl)-4-methoxyphenoxy]phenyl]methyl]-1H-imidazole |
| Manual Xrefs | Databases |
|---|---|
| HMDB0032717 | HMDB |
| 30776950 | ChemSpider |