Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027461
PROPERTIES
| NPAID | NPA027461 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | Nodulapeptin 863 |
| FORMULA | C45H65N7O10 |
| MOLECULAR WEIGHT (Da) | 864.0540 |
| ACCURATE MASS (Da) | 863.4793 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena |
| InChIKey | JWTLSWXNBWLNPD-UHFFFAOYSA-N |
| InChI | InChI=1S/C45H65N7O10/c1-7-28(3)37-42(57)47-34(24-22-31-17-11-9-12-18-31)43(58)52(6)36(25-23-32-19-13-10-14-20-32)41(56)48-35(27-62-30(5)53)39(54)46-26-16-15-21-33(40(55)50-37)49-45(61)51-38(44(59)60)29(4)8-2/h9-14,17-20,28-29,33-38H,7-8,15-16,21-27H2,1-6H3,(H,46,54)(H,47,57)(H,48,56)(H,50,55)(H,59,60)(H2,49,51,61) |
| SMILES | CCC(C)C(NC(=O)NC1CCCCNC(=O)C(COC(C)=O)NC(=O)C(CCC2=CC=CC=C2)N(C)C(=O)C(CCC2=CC=CC=C2)NC(=O)C(C(C)CC)NC1=O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Mazur-Marzec H; Bertos-Fortis M; Toruńska-Sitarz A; Fidor A; Legrand C Chemical and Genetic Diversity of Nodularia spumigena from the Baltic Sea. Marine Drugs 2016 14 (11) None. | ||
|---|---|---|---|
| DOI | 10.3390/md14110209 | PMID | 27834904 |
