Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA031573
PROPERTIES
NPAID | NPA031573 |
---|---|
CLUSTER ID | 9191 |
NODE ID | 6170 |
NAME | F-Bac |
FORMULA | C12H19FN2O5 |
MOLECULAR WEIGHT (Da) | 290.2910 |
ACCURATE MASS (Da) | 290.1278 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Helicobacter |
ORIGIN SPECIES | pylori |
InChIKey | JWSCPNNAFMMGLY-BKPRMLKUSA-N |
InChI | InChI=1S/C12H19FN2O5/c1-5-10(14-6(2)16)9(13)11(15-7(3)17)12(19-5)20-8(4)18/h5,9-12H,1-4H3,(H,14,16)(H,15,17)/t5-,9+,10-,11-,12-/m1/s1 |
SMILES | CC(=O)N[C@@H]1[C@@H](F)[C@H](NC(C)=O)[C@@H](C)O[C@@H]1OC(C)=O |
ORIGINAL ISOLATION REFERENCE
CITATION | Williams, Daniel A; Pradhan, Kabita; Paul, Ankita; Olin, Ilana R; Tuck, Owen T; Moulton, Karen D; Kulkarni, Suvarn S; Dube, Danielle H Metabolic inhibitors of bacterial glycan biosynthesis. Chemical Science 2020 11 (7) 1761-1774. | ||
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DOI | 10.1039/c9sc05955e | PMID | 34123271 |