Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005737998 | Gold | 3 |
| CCMSLIB00005738260 | Gold | 3 |
| CCMSLIB00005738157 | Gold | 3 |
| CCMSLIB00005723697 | Gold | 3 |
| CCMSLIB00012126551 | Gold | 4 |
| CCMSLIB00009966348 | Gold | 4 |
COMPOUND NPA011271
PROPERTIES
| NPAID | NPA011271 |
|---|---|
| CLUSTER ID | 1041 |
| NODE ID | 509 |
| NAME | N-3-oxohexanoyl-L-homoserine lactone |
| FORMULA | C12H21NO3 |
| MOLECULAR WEIGHT (Da) | 227.3040 |
| ACCURATE MASS (Da) | 227.1521 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Photobacterium |
| ORIGIN SPECIES | fischeri strain MJ-1 |
| InChIKey | JKEJEOJPJVRHMQ-JTQLQIEISA-N |
| InChI | InChI=1S/C12H21NO3/c1-2-3-4-5-6-7-11(14)13-10-8-9-16-12(10)15/h10H,2-9H2,1H3,(H,13,14)/t10-/m0/s1 |
| SMILES | CCCCCCCC(=O)N[C@H]1CCOC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Eberhard A, Burlingame AL, Eberhard C, Kenyon GL, Nealson KH, Oppenheimer NJ Structural identification of autoinducer of Photobacterium fischeri luciferase Biochemistry 1981 20 (9) 2444-2449. | ||
|---|---|---|---|
| DOI | 10.1021/bi00512a013 | PMID | 7236614 |
