EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H24O6 |
| Net Charge | 0 |
| Average Mass | 372.417 |
| Monoisotopic Mass | 372.15729 |
| SMILES | COc1c(C)cc(O)c2c1[C@H](O)[C@]1(C(=O)C(CC=C(C)C)=CC[C@H]1O)C2=O |
| InChI | InChI=1S/C21H24O6/c1-10(2)5-6-12-7-8-14(23)21(18(12)24)19(25)15-13(22)9-11(3)17(27-4)16(15)20(21)26/h5,7,9,14,20,22-23,26H,6,8H2,1-4H3/t14-,20+,21-/m1/s1 |
| InChIKey | KIGLYXNVNQDBTF-PUCZYUMASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Dictyosporiumspecies (ncbitaxon:2011768) | - | PubMed (30600998) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dictyosporione A (CHEBI:222949) is a indanones (CHEBI:24789) |
| IUPAC Name |
|---|
| (2R,3S,5'R)-3,5',7-trihydroxy-4-methoxy-5-methyl-2'-(3-methylbut-2-enyl)spiro[3H-indene-2,6'-cyclohex-2-ene]-1,1'-dione |