Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015739
PROPERTIES
| NPAID | NPA015739 |
|---|---|
| CLUSTER ID | 5480 |
| NODE ID | 3897 |
| NAME | Tabtoxin |
| FORMULA | C11H19N3O6 |
| MOLECULAR WEIGHT (Da) | 289.2880 |
| ACCURATE MASS (Da) | 289.1274 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudomonas |
| ORIGIN SPECIES | tabaci |
| InChIKey | BFSBNVPBVGFFCF-UHFFFAOYSA-N |
| InChI | InChI=1S/C11H19N3O6/c1-5(15)7(9(17)18)14-8(16)6(12)2-3-11(20)4-13-10(11)19/h5-7,15,20H,2-4,12H2,1H3,(H,13,19)(H,14,16)(H,17,18) |
| SMILES | CC(C(C(=O)O)NC(=O)C(CCC1(CNC1=O)O)N)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Stewart, Walter W Isolation and proof of structure of wildfire toxin Nature 1971 229 (5281) 174. | ||
|---|---|---|---|
| DOI | 10.1038/229174a0 | PMID | 4923261 |
