Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027769
PROPERTIES
| NPAID | NPA027769 |
|---|---|
| CLUSTER ID | 8309 |
| NODE ID | 3667 |
| NAME | Decarboxyunguinolic acid |
| FORMULA | C18H20O4 |
| MOLECULAR WEIGHT (Da) | 300.3540 |
| ACCURATE MASS (Da) | 300.1362 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | unguis |
| InChIKey | RSKUSVAJGZVWLB-VZUCSPMQSA-N |
| InChI | InChI=1S/C18H20O4/c1-5-11(3)15-9-16(20)12(4)17(21)18(15)22-14-7-10(2)6-13(19)8-14/h5-9,19-21H,1-4H3/b11-5+ |
| SMILES | C/C=C(\C)C1=CC(O)=C(C)C(O)=C1OC1=CC(C)=CC(O)=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Morshed, Mahmud T.; Vuong, Daniel; Crombie, Andrew; Lacey, Alastair E.; Karuso, Peter; Lacey, Ernest; Piggott, Andrew M. Expanding antibiotic chemical space around the nidulin pharmacophore Organic & Biomolecular Chemistry 2018 16 (16) 3038-3051. | ||
|---|---|---|---|
| DOI | 10.1039/c8ob00545a | PMID | 29634062 |
