Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013061
PROPERTIES
| NPAID | NPA013061 |
|---|---|
| CLUSTER ID | 4834 |
| NODE ID | 11 |
| NAME | Barakacin |
| FORMULA | C26H19N3OS |
| MOLECULAR WEIGHT (Da) | 421.5250 |
| ACCURATE MASS (Da) | 421.1249 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudomonas |
| ORIGIN SPECIES | sp. |
| InChIKey | GRPVXIRSGACTEG-UHFFFAOYSA-N |
| InChI | InChI=1S/C26H19N3OS/c30-24-12-6-3-9-18(24)26-29-23(15-31-26)25(19-13-27-21-10-4-1-7-16(19)21)20-14-28-22-11-5-2-8-17(20)22/h1-15,25,27-28,30H |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C(C3=CNC4=CC=CC=C43)C5=CSC(=N5)C6=CC=CC=C6O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zendah, Imene; Shaaban, Khaled A.; Helmke, Elisabeth; Maier, Armin; Fiebig, Heinz H.; Laatsch, Hartmut Barakacin: A Thiazolyl-indole Alkaloid Isolated from a Ruminal Pseudomonas sp Zeitschrift fur Naturforschung B: Journal of Chemical Sciences 2012 67 417-420. | ||
|---|---|---|---|
| DOI | 10.5560/znb.2011-0277 | PMID | - |
