Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012801
PROPERTIES
| NPAID | NPA012801 |
|---|---|
| CLUSTER ID | 811 |
| NODE ID | 704 |
| NAME | Pyranonigrin A |
| FORMULA | C10H9NO5 |
| MOLECULAR WEIGHT (Da) | 223.1840 |
| ACCURATE MASS (Da) | 223.0481 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | niger LL-LV3020 |
| InChIKey | OALBJWDVDNROSF-VMZHVLLKSA-N |
| InChI | InChI=1S/C10H9NO5/c1-2-3-4-6(12)7(13)5-8(16-4)10(15)11-9(5)14/h2-3,10,12,15H,1H3,(H,11,14)/b3-2+/t10-/m1/s1 |
| SMILES | C/C=C/C1=C(C(=O)C2=C(O1)[C@H](NC2=O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Schlingmann, Gerhard; Taniguchi, Tohru; He, Haiyin; Bigelis, Ramunas; Yang, Hui Y.; Koehn, Frank E.; Carter, Guy T.; Berova, Nina Reassessing the Structure of Pyranonigrin Journal of Natural Products 2007 70 (7) 1180-1187. | ||
|---|---|---|---|
| DOI | 10.1021/np070175n | PMID | 17604395 |
