EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H40O8 |
| Net Charge | 0 |
| Average Mass | 480.598 |
| Monoisotopic Mass | 480.27232 |
| SMILES | CO[C@H]1O[C@@]2(O)[C@H](O)CO[C@H]3O[C@H]4[C@@H]([C@@H]1CC[C@@H]1C5=C(C(C)C)C[C@H](O)[C@]5(C)CC[C@]14C)[C@]32O |
| InChI | InChI=1S/C26H40O8/c1-12(2)14-10-16(27)24(4)9-8-23(3)15(18(14)24)7-6-13-19-20(23)33-22-25(19,29)26(30,17(28)11-32-22)34-21(13)31-5/h12-13,15-17,19-22,27-30H,6-11H2,1-5H3/t13-,15+,16-,17+,19+,20-,21-,22-,23+,24-,25-,26-/m0/s1 |
| InChIKey | JYWNCDPDOPIRTK-JSPUZNANSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cyathus striatus (ncbitaxon:68777) | - | PubMed (25746852) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Striatoid A (CHEBI:199512) is a diterpenoid (CHEBI:23849) |
| IUPAC Name |
|---|
| (1S,2R,5R,6S,10R,13S,14S,16S,17R,20S,21S,22R)-14-methoxy-2,5-dimethyl-8-propan-2-yl-15,19,23-trioxahexacyclo[18.2.1.02,10.05,9.013,22.016,21]tricos-8-ene-6,16,17,21-tetrol |
| Manual Xrefs | Databases |
|---|---|
| 58838873 | ChemSpider |