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CHEBI:230421 - Chandalone
| Formula | C25H24O5 |
| Net Charge | 0 |
| Average Mass | 404.462 |
| Monoisotopic Mass | 404.16237 |
| SMILES | CC(C)=CCc1cc(-c2coc3cc4c(c(O)c3c2=O)C=CC(C)(C)O4)ccc1O |
| InChI | InChI=1S/C25H24O5/c1-14(2)5-6-16-11-15(7-8-19(16)26)18-13-29-21-12-20-17(9-10-25(3,4)30-20)23(27)22(21)24(18)28/h5,7-13,26-27H,6H2,1-4H3 |
| InChIKey | MSKODIWLGXEVTN-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS9100) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Chandalone (CHEBI:230421) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| 5-hydroxy-7-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-2,2-dimethylpyrano[3,2-g]chromen-6-one |
| Manual Xrefs | Databases |
|---|---|
| 24842773 | ChemSpider |
| HMDB0304612 | HMDB |
| LMPK12050204 | LIPID MAPS |