Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000001575 | Gold | 1 |
| CCMSLIB00000001573 | Gold | 1 |
COMPOUND NPA018714
PROPERTIES
| NPAID | NPA018714 |
|---|---|
| CLUSTER ID | 3162 |
| NODE ID | 2409 |
| NAME | Barbamide |
| FORMULA | C20H23Cl3N2O2S |
| MOLECULAR WEIGHT (Da) | 461.8420 |
| ACCURATE MASS (Da) | 460.0546 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | majuscula |
| InChIKey | UGNRFJOMRFTXSQ-DTQAZKPQSA-N |
| InChI | InChI=1S/C20H23Cl3N2O2S/c1-14(20(21,22)23)11-16(27-3)13-18(26)25(2)17(19-24-9-10-28-19)12-15-7-5-4-6-8-15/h4-10,13-14,17H,11-12H2,1-3H3/b16-13+ |
| SMILES | CC(C/C(=C\C(=O)N(C)C(CC1=CC=CC=C1)C2=NC=CS2)/OC)C(Cl)(Cl)Cl |
ORIGINAL ISOLATION REFERENCE
| CITATION | Orjala, Jimmy; Gerwick, William H. Barbamide, a chlorinated metabolite with molluscicidal activity from the Caribbean cyanobacterium Lyngbya majuscula Journal of Natural Products 1996 59 (4) 427-430. | ||
|---|---|---|---|
| DOI | 10.1021/np960085a | PMID | 8699186 |
SYNTHESES
| CITATION 1 | Nguyen VA; Willis CL; Gerwick WH Synthesis of the marine natural product barbamide. Chemical Communications 2001 (19) 1934-1935. DOI: 10.1039/b106087m PMID: 12240226 | ||
|---|---|---|---|
| CITATION 2 | Ilardi EA; Zakarian A Efficient total synthesis of dysidenin, dysidin, and barbamide. Chemistry – An Asian Journal 2011 6 (9) 2260-2263. DOI: 10.1002/asia.201100338 PMID: 21698777 | ||
