Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004982
PROPERTIES
| NPAID | NPA004982 |
|---|---|
| CLUSTER ID | 2507 |
| NODE ID | 1965 |
| NAME | Fumisoquin C |
| FORMULA | C13H10N2O6 |
| MOLECULAR WEIGHT (Da) | 290.2310 |
| ACCURATE MASS (Da) | 290.0539 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | fumigatus |
| InChIKey | UQCMMCKISQFOFC-FSPLSTOPSA-N |
| InChI | InChI=1S/C13H10N2O6/c16-6-2-8(18)12(19)4-3-14-10-7(17)1-5(13(20)21)15-11(10)9(4)6/h2-3,5,7,15-17H,1H2,(H,20,21)/t5-,7-/m0/s1 |
| SMILES | O=C1C=C(O)C2=C3N[C@H](C(=O)O)C[C@H](O)C3=NC=C2C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Baccile, Joshua A.; Spraker, Joseph E.; Le, Henry H.; Brandenburger, Eileen; Gomez, Christian; Bok, Jin Woo; MacHeleidt, Juliane; Brakhage, Axel A.; Hoffmeister, Dirk; Keller, Nancy P.; Schroeder, Frank C. Plant-like biosynthesis of isoquinoline alkaloids in Aspergillus fumigatus Nature Chemical Biology 2016 12 (6) 419-424. | ||
|---|---|---|---|
| DOI | 10.1038/nchembio.2061 | PMID | 27065235 |
