Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005295
PROPERTIES
| NPAID | NPA005295 |
|---|---|
| CLUSTER ID | 863 |
| NODE ID | 747 |
| NAME | Melleolide |
| FORMULA | C23H28O6 |
| MOLECULAR WEIGHT (Da) | 400.4710 |
| ACCURATE MASS (Da) | 400.1886 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Armillaria |
| ORIGIN SPECIES | mellea |
| InChIKey | SJZRUQOYQZRISL-IDOJSZHESA-N |
| InChI | InChI=1S/C23H28O6/c1-12-5-15(25)7-17(26)19(12)20(27)29-18-10-22(4)16-9-21(2,3)8-13(16)6-14(11-24)23(18,22)28/h5-7,11,13,16,18,25-26,28H,8-10H2,1-4H3/t13-,16+,18-,22-,23+/m1/s1 |
| SMILES | CC1=CC(=CC(=C1C(=O)O[C@@H]2C[C@]3([C@@]2(C(=C[C@H]4[C@@H]3CC(C4)(C)C)C=O)O)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Midland, Sharon L.; Izac, Richard R.; Wing, Richard M.; Zaki, A. I.; Munnecke, D. E.; Sims, James J. MELLEOLIDE, A NEW ANTIBIOTIC FROM ARMILLARIA MELLEA Tetrahedron Letters 1982 23 (25) 2515-2518. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(00)87383-9 | PMID | - |
