EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H30O3 |
| Net Charge | 0 |
| Average Mass | 330.468 |
| Monoisotopic Mass | 330.21949 |
| SMILES | CO[C@H]1C(=O)[C@]2(C)CC[C@@]3(C)CCC(C(C)C)=C3[C@H]2CC=C1C=O |
| InChI | InChI=1S/C21H30O3/c1-13(2)15-8-9-20(3)10-11-21(4)16(17(15)20)7-6-14(12-22)18(24-5)19(21)23/h6,12-13,16,18H,7-11H2,1-5H3/t16-,18-,20-,21-/m1/s1 |
| InChIKey | MHJIISMBXWZQGF-KRZXBLKESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cyathus hookeri (ncbitaxon:380659) | - | PubMed (31244147) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cyahookerin F (CHEBI:224135) is a diterpenoid (CHEBI:23849) |
| IUPAC Name |
|---|
| (3aR,5aR,7R,10aR)-7-methoxy-3a,5a-dimethyl-6-oxo-1-propan-2-yl-3,4,5,7,10,10a-hexahydro-2H-cyclohepta[e]indene-8-carbaldehyde |