EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H14O5 |
| Net Charge | 0 |
| Average Mass | 334.327 |
| Monoisotopic Mass | 334.08412 |
| SMILES | CC1(C)C=Cc2cc3c(cc2O1)oc1c2ccc(O)cc2oc(=O)c31 |
| InChI | InChI=1S/C20H14O5/c1-20(2)6-5-10-7-13-16(9-14(10)25-20)23-18-12-4-3-11(21)8-15(12)24-19(22)17(13)18/h3-9,21H,1-2H3 |
| InChIKey | JOMJKDWBAPDZIF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Sophoracoumestan A (CHEBI:166609) is a coumestans (CHEBI:72577) |
| IUPAC Name |
|---|
| 17-hydroxy-7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,9,14(19),15,17-octaen-21-one |
| Manual Xrefs | Databases |
|---|---|
| LMPK12090013 | LIPID MAPS |
| 24843107 | ChemSpider |