Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016238
PROPERTIES
| NPAID | NPA016238 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Murayaquinone |
| FORMULA | C19H16O5 |
| MOLECULAR WEIGHT (Da) | 324.3320 |
| ACCURATE MASS (Da) | 324.0998 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | metabolite |
| InChIKey | YJQYHFMKGAVKDP-UHFFFAOYSA-N |
| InChI | InChI=1S/C19H16O5/c1-3-5-13(20)11-8-12-10-6-4-7-14(21)15(10)18(23)19(24)16(12)17(22)9(11)2/h4,6-8,21-22H,3,5H2,1-2H3 |
| SMILES | CCCC(=O)C1=C(C(=C2C(=C1)C3=C(C(=CC=C3)O)C(=O)C2=O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sato, Yukiharu; Kohnert, Rodger; Gould, Steven J. Application of Long Range 1H/13C Heteronuclear Correlation Spectroscopy (LR HETCOSY) to Structure Elucidation: The Structure of Murayaquinone Tetrahedron Letters 1986 27 (2) 143-146. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(00)83962-3 | PMID | - |
