EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H33NO4 |
| Net Charge | 0 |
| Average Mass | 471.597 |
| Monoisotopic Mass | 471.24096 |
| SMILES | COc1ccc(C2=C(Cc3ccc(OCCN4CCCCC4)cc3)c3ccc(O)cc3OC2)cc1 |
| InChI | InChI=1S/C30H33NO4/c1-33-25-12-7-23(8-13-25)29-21-35-30-20-24(32)9-14-27(30)28(29)19-22-5-10-26(11-6-22)34-18-17-31-15-3-2-4-16-31/h5-14,20,32H,2-4,15-19,21H2,1H3 |
| InChIKey | ZUDXUNPSRMREOJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| chf4227 (CHEBI:755592) is a ether (CHEBI:25698) |
| chf4227 (CHEBI:755592) is a flavonoids (CHEBI:72544) |
| Synonym | Source |
|---|---|
| Chf4227 | ChEMBL |