EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H27ClN4O5 |
| Net Charge | 0 |
| Average Mass | 462.934 |
| Monoisotopic Mass | 462.16700 |
| SMILES | COc1cc2ncnc(Nc3ccc(O)c(Cl)c3)c2cc1OCCCN(CO)CCCO |
| InChI | InChI=1S/C22H27ClN4O5/c1-31-20-12-18-16(11-21(20)32-9-3-7-27(14-29)6-2-8-28)22(25-13-24-18)26-15-4-5-19(30)17(23)10-15/h4-5,10-13,28-30H,2-3,6-9,14H2,1H3,(H,24,25,26) |
| InChIKey | OETKSEAPYWARBK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-chloro-4-[(6-{3-[(hydroxymethyl)(3-hydroxypropyl)amino]propoxy}-7-methoxyquinazolin-4-yl)amino]phenol (CHEBI:143402) is a quinazolines (CHEBI:38530) |