Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025200
PROPERTIES
| NPAID | NPA025200 |
|---|---|
| CLUSTER ID | 7659 |
| NODE ID | 5232 |
| NAME | Aiorsellinate A |
| FORMULA | C20H30O9 |
| MOLECULAR WEIGHT (Da) | 414.4510 |
| ACCURATE MASS (Da) | 414.1890 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aioliomyces |
| ORIGIN SPECIES | pyridodomos |
| InChIKey | KENUTGGSBUARDW-FXRXJOCMSA-N |
| InChI | InChI=1S/C20H30O9/c1-10(2)5-6-12-13(23)7-11(3)16(18(12)28-4)20(27)29-19(15(25)9-22)17(26)14(24)8-21/h5,7,14-15,17,19,21-26H,6,8-9H2,1-4H3/t14-,15-,17-,19-/m1/s1 |
| SMILES | CC1=CC(=C(C(=C1C(=O)O[C@H]([C@@H](CO)O)[C@@H]([C@@H](CO)O)O)OC)CC=C(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lin Z; Kakule TB; Reilly CA; Beyhan S; Schmidt EW Secondary Metabolites of Onygenales Fungi Exemplified by Aioliomyces pyridodomos. Journal of Natural Products 2019 82 (6) 1616-1626. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.9b00121 | PMID | 31155876 |
