EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H22O9 |
| Net Charge | 0 |
| Average Mass | 430.409 |
| Monoisotopic Mass | 430.12638 |
| SMILES | COc1cc2c(c(O)c1COCc1c(OC)cc3c(c1O)C(=O)OCC3)C(=O)OCC2 |
| InChI | InChI=1S/C22H22O9/c1-27-15-7-11-3-5-30-21(25)17(11)19(23)13(15)9-29-10-14-16(28-2)8-12-4-6-31-22(26)18(12)20(14)24/h7-8,23-24H,3-6,9-10H2,1-2H3 |
| InChIKey | BLQFWMPMIIOMSF-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillusspecies (ncbitaxon:5065) | - | PubMed (27829913) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asperisocoumarin F (CHEBI:206052) is a 2-benzopyran (CHEBI:38444) |
| IUPAC Name |
|---|
| 8-hydroxy-7-[(8-hydroxy-6-methoxy-1-oxo-3,4-dihydroisochromen-7-yl)methoxymethyl]-6-methoxy-3,4-dihydroisochromen-1-one |
| Manual Xrefs | Databases |
|---|---|
| 60596816 | ChemSpider |