Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012134
PROPERTIES
| NPAID | NPA012134 |
|---|---|
| CLUSTER ID | 550 |
| NODE ID | 492 |
| NAME | 1,4-di-O-acetyl hygrophorone E12 |
| FORMULA | C22H36O6 |
| MOLECULAR WEIGHT (Da) | 396.5240 |
| ACCURATE MASS (Da) | 396.2512 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hygrophorus |
| ORIGIN SPECIES | persoonii |
| InChIKey | PMRNSRSBCILCAS-ITAUSPCMSA-N |
| InChI | InChI=1S/C22H36O6/c1-4-5-6-7-8-9-10-11-12-13-14-19(25)22(26)20(27-17(2)23)15-16-21(22)28-18(3)24/h15-16,20-21,26H,4-14H2,1-3H3/t20-,21?,22?/m1/s1 |
| SMILES | CCCCCCCCCCCCC(=O)C1([C@@H](C=CC1OC(=O)C)OC(=O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Luebken, Tilo; Schmidt, Juergen; Porzel, Andrea; Arnold, Norbert; Wessjohann, Ludger Hygrophorones A-G: Fungicidal cyclopentenones from Hygrophorus species (Basidiomycetes) Phytochemistry 2004 65 (8) 1061-1071. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2004.01.023 | PMID | 15110686 |
