Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017237
PROPERTIES
| NPAID | NPA017237 |
|---|---|
| CLUSTER ID | 5062 |
| NODE ID | 1627 |
| NAME | Phomalairdenone B |
| FORMULA | C15H22O2 |
| MOLECULAR WEIGHT (Da) | 234.3390 |
| ACCURATE MASS (Da) | 234.1620 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Leptosphaeria |
| ORIGIN SPECIES | maculans |
| InChIKey | GFYRIASLJUKILU-VDPPQRJLSA-N |
| InChI | InChI=1S/C15H22O2/c1-9-7-10(16)12-13(2,3)8-14(4)11(17)5-6-15(9,12)14/h5-6,9-10,12,16H,7-8H2,1-4H3/t9-,10+,12+,14-,15+/m1/s1 |
| SMILES | C[C@@H]1C[C@@H]([C@@H]2[C@]13C=CC(=O)[C@]3(CC2(C)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pedras, M Soledade C; Chumala, Paulos B; Venkatesham, Uppala New sesquiterpenic phytotoxins establish unprecedented relationship between different groups of blackleg fungal isolates Bioorganic and Medicinal Chemistry 2005 13 (7) 2469-2475. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmc.2005.01.040 | PMID | 15755649 |
