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CHEBI:208613 - Primarolide B
| Formula | C27H25NO5 |
| Net Charge | 0 |
| Average Mass | 443.499 |
| Monoisotopic Mass | 443.17327 |
| SMILES | COc1c(C)cc2c(c1O)C(=O)N(c1ccccc1)[C@@H]2c1c(O)ccc2c1OC(C)(C)C=C2 |
| InChI | InChI=1S/C27H25NO5/c1-15-14-18-20(23(30)24(15)32-4)26(31)28(17-8-6-5-7-9-17)22(18)21-19(29)11-10-16-12-13-27(2,3)33-25(16)21/h5-14,22,29-30H,1-4H3/t22-/m0/s1 |
| InChIKey | MAPMWKAHOFUWRT-QFIPXVFZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Asteromyces cruciatus (ncbitaxon:1407621) | - | PubMed (31344982) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Primarolide B (CHEBI:208613) is a 1-benzopyran (CHEBI:38443) |
| IUPAC Name |
|---|
| 7-hydroxy-3-(7-hydroxy-2,2-dimethylchromen-8-yl)-6-methoxy-5-methyl-2-phenyl-3H-isoindol-1-one |
| Manual Xrefs | Databases |
|---|---|
| 77005937 | ChemSpider |