Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000072529 | Gold | 2!CCMSLIB00000072530 |
COMPOUND NPA011297
PROPERTIES
| NPAID | NPA011297 |
|---|---|
| CLUSTER ID | 3326 |
| NODE ID | 2521 |
| NAME | Antillatoxin B |
| FORMULA | C33H47N3O5 |
| MOLECULAR WEIGHT (Da) | 565.7550 |
| ACCURATE MASS (Da) | 565.3516 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | majuscula |
| InChIKey | WBQWYSKGOKXFTF-OHAAWPAWSA-N |
| InChI | InChI=1S/C33H47N3O5/c1-21(19-33(6,7)8)17-23(3)30-24(4)22(2)18-28(37)35-25(5)32(40)36(9)27(31(39)34-20-29(38)41-30)16-15-26-13-11-10-12-14-26/h10-14,17,19,24-25,27,30H,2,15-16,18,20H2,1,3-9H3,(H,34,39)(H,35,37)/b21-19+,23-17+/t24-,25+,27+,30+/m1/s1 |
| SMILES | C[C@H]1[C@@H](OC(=O)CNC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)CC1=C)C)C)CCC2=CC=CC=C2)/C(=C/C(=C/C(C)(C)C)/C)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Nogle; Okino; Gerwick Antillatoxin B, a neurotoxic lipopeptide from the marine cyanobacterium Lyngbya majuscula Journal of Natural Products 2001 64 (7) 983-985. | ||
|---|---|---|---|
| DOI | 10.1021/np010107f | PMID | 11473443 |
