EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H36O5 |
| Net Charge | 0 |
| Average Mass | 416.558 |
| Monoisotopic Mass | 416.25627 |
| SMILES | CC(C)=CCC1(CC=C(C)C)C(=O)C(C(=O)C(C)C)=C2OC(C(C)(C)O)CC2=C1O |
| InChI | InChI=1S/C25H36O5/c1-14(2)9-11-25(12-10-15(3)4)22(27)17-13-18(24(7,8)29)30-21(17)19(23(25)28)20(26)16(5)6/h9-10,16,18,27,29H,11-13H2,1-8H3 |
| InChIKey | ZAIOIYBNXHWCBT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Colupox a (CHEBI:175332) is a benzofurans (CHEBI:35259) |
| IUPAC Name |
|---|
| 4-hydroxy-2-(2-hydroxypropan-2-yl)-5,5-bis(3-methylbut-2-enyl)-7-(2-methylpropanoyl)-2,3-dihydro-1-benzouran-6-one |
| Manual Xrefs | Databases |
|---|---|
| 68023881 | ChemSpider |