Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024731
PROPERTIES
| NPAID | NPA024731 |
|---|---|
| CLUSTER ID | 863 |
| NODE ID | 747 |
| NAME | Melleolide B |
| FORMULA | C24H32O7 |
| MOLECULAR WEIGHT (Da) | 432.5130 |
| ACCURATE MASS (Da) | 432.2148 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Armillaria |
| ORIGIN SPECIES | mellae |
| InChIKey | NHDJKXOHRUHQHG-MFWOBCTISA-N |
| InChI | InChI=1S/C24H32O7/c1-12-6-15(30-5)8-16(26)18(12)21(28)31-17-10-23(4)19-13(9-22(2,3)20(19)27)7-14(11-25)24(17,23)29/h6-8,13,17,19-20,25-27,29H,9-11H2,1-5H3/t13?,17-,19-,20-,23-,24+/m1/s1 |
| SMILES | CC1=CC(=CC(=C1C(=O)O[C@@H]2C[C@]3([C@@]2(C(=CC4[C@@H]3[C@H](C(C4)(C)C)O)CO)O)C)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Arnone, A;Cardillo, R; Nasini, G Structures of melleolides B-D, three antibacterial sesquiterpenoids from Armillaria mellea Phytochemistry 1986 25 (2) 471-474. | ||
|---|---|---|---|
| DOI | 10.1016/S0031-9422(00)85503-X | PMID | - |
