Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006167
PROPERTIES
| NPAID | NPA006167 |
|---|---|
| CLUSTER ID | 837 |
| NODE ID | 726 |
| NAME | Phomalactone deriv. II |
| FORMULA | C22H30O6 |
| MOLECULAR WEIGHT (Da) | 390.4760 |
| ACCURATE MASS (Da) | 390.2042 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phomopsis |
| ORIGIN SPECIES | sp. |
| InChIKey | SZTWZPUAGRSHIP-MVUYCZRSSA-N |
| InChI | InChI=1S/C22H30O6/c1-4-5-6-7-8-16(2)15-17(3)9-13-21(25)28-19-11-14-22(26)27-18(19)10-12-20(23)24/h9-16,18-19H,4-8H2,1-3H3,(H,23,24)/b12-10+,13-9+,17-15+/t16?,18-,19-/m0/s1 |
| SMILES | CCCCCCC(C)/C=C(\C)/C=C/C(=O)O[C@H]1C=CC(=O)O[C@H]1/C=C/C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | WRIGLEY, STEPHEN K.; SADEGHI, ROYA; BAHL, SANGEETA; WHITING, ANDREW J.; AINSWORTH, A. MARTYN; MARTIN, STEVEN M.; KATZER, WERNER; FORD, ROBERT; KAU, DAVID A.; ROBINSON, NEIL; HAYES, MARTIN A.; ELCOCK, CLAIRE; MANDER, THOMAS; MOORES, MICHAEL A novel (6S)-4,6-dimethyldodeca-2E,4E-dienoyl ester of phomalactone and related alpha-pyrone esters from a Phomopsis sp. with cytokine production inhibitory activity Journal of Antibiotics 1999 52 (10) 862-872. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.52.862 | PMID | 10604755 |
