Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028639
PROPERTIES
| NPAID | NPA028639 |
|---|---|
| CLUSTER ID | 1751 |
| NODE ID | 1420 |
| NAME | NX-4 |
| FORMULA | C17H24O6 |
| MOLECULAR WEIGHT (Da) | 324.3730 |
| ACCURATE MASS (Da) | 324.1573 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Fusarium |
| ORIGIN SPECIES | graminearum |
| InChIKey | STALRVVTTNCRSI-SFMCAAARSA-N |
| InChI | InChI=1S/C17H24O6/c1-9-4-12(20)16(7-21-10(2)18)13(5-9)23-14-11(19)6-15(16,3)17(14)8-22-17/h5,11-14,19-20H,4,6-8H2,1-3H3/t11-,12-,13-,14?,15-,16+,17?/m1/s1 |
| SMILES | CC(=O)OC[C@]12[C@H](O)CC(C)=C[C@H]1OC1[C@H](O)C[C@@]2(C)C12CO2 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Varga E; Wiesenberger G; Hametner C; Ward TJ; Dong Y; Schöfbeck D; McCormick S; Broz K; Stückler R; Schuhmacher R; Krska R; Kistler HC; Berthiller F; Adam G New tricks of an old enemy: isolates of Fusarium graminearum produce a type A trichothecene mycotoxin. Environmental Microbiology 2015 17 (8) 2588-2600. | ||
|---|---|---|---|
| DOI | 10.1111/1462-2920.12718 | PMID | 25403493 |
