Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014075
PROPERTIES
| NPAID | NPA014075 |
|---|---|
| CLUSTER ID | 863 |
| NODE ID | 747 |
| NAME | Dehydroarmillylorsellinate |
| FORMULA | C23H28O6 |
| MOLECULAR WEIGHT (Da) | 400.4710 |
| ACCURATE MASS (Da) | 400.1886 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Armillaria |
| ORIGIN SPECIES | mellea FR-P75 |
| InChIKey | ZXLVDZRNPKMJND-NJORCMFTSA-N |
| InChI | InChI=1S/C23H28O6/c1-11-5-12(25)6-16(26)18(11)21(28)29-17-9-23(4)15-8-22(2,3)7-13(15)20(27)14(10-24)19(17)23/h5-6,10,13,15,17,20,25-27H,7-9H2,1-4H3/t13-,15+,17-,20+,23-/m1/s1 |
| SMILES | CC1=CC(=CC(=C1C(=O)O[C@@H]2C[C@]3(C2=C([C@H]([C@H]4[C@@H]3CC(C4)(C)C)O)C=O)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Bohnert, Markus; Miethbauer, Sebastian; Dahse, Hans-Martin; Ziemen, Johannes; Nett, Markus; Hoffmeister, Dirk In vitro cytotoxicity of melleolide antibiotics: Structural and mechanistic aspects Bioorganic and Medicinal Chemistry Letters 2011 21 (7) 2003-2006. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmcl.2011.02.026 | PMID | 21376582 |
