EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H33N3O3 |
| Net Charge | 0 |
| Average Mass | 459.590 |
| Monoisotopic Mass | 459.25219 |
| SMILES | C=CC(C)(C)C1=Nc2c(CC=C(C)C)cc(CC=C(C)C)cc2C1=Cc1nc(=O)c(=O)nc1O |
| InChI | InChI=1S/C28H33N3O3/c1-8-28(6,7)24-21(15-22-25(32)31-27(34)26(33)29-22)20-14-18(11-9-16(2)3)13-19(23(20)30-24)12-10-17(4)5/h8-10,13-15H,1,11-12H2,2-7H3,(H,29,33)(H2,31,32,34) |
| InChIKey | QBHLUAIWFDJXQG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus ruber (ncbitaxon:396024) | - | DOI (10.1002/hlca.201100255) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 12-demethyl-12-oxo-eurotechinulin B (CHEBI:213609) is a indoles (CHEBI:24828) |
| IUPAC Name |
|---|
| 5-hydroxy-6-[[2-(2-methylbut-3-en-2-yl)-5,7-bis(3-methylbut-2-enyl)indol-3-ylidene]methyl]-1,4-dihydropyrazine-2,3-dione |