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CHEBI:208401 - Aspernolide P
| Formula | C25H26O8 |
| Net Charge | 0 |
| Average Mass | 454.475 |
| Monoisotopic Mass | 454.16277 |
| SMILES | CCOC(=O)[C@]1(Cc2ccc3c(c2)CC(O)C(C)(C)O3)OC(=O)C(O)=C1c1ccc(O)cc1 |
| InChI | InChI=1S/C25H26O8/c1-4-31-23(30)25(20(21(28)22(29)33-25)15-6-8-17(26)9-7-15)13-14-5-10-18-16(11-14)12-19(27)24(2,3)32-18/h5-11,19,26-28H,4,12-13H2,1-3H3/t19?,25-/m1/s1 |
| InChIKey | YGNQCPMMANWUQE-OPEAARRCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | PubMed (31163670) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Aspernolide P (CHEBI:208401) is a 1-benzopyran (CHEBI:38443) |
| IUPAC Name |
|---|
| ethyl (2R)-4-hydroxy-2-[(3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)methyl]-3-(4-hydroxyphenyl)-5-oxouran-2-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 76117736 | ChemSpider |