Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027466
PROPERTIES
| NPAID | NPA027466 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | Nodulapeptin 851 |
| FORMULA | C44H65N7O8S |
| MOLECULAR WEIGHT (Da) | 852.1120 |
| ACCURATE MASS (Da) | 851.4615 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena |
| InChIKey | HZXYJCCVMAKAEX-UHFFFAOYSA-N |
| InChI | InChI=1S/C44H65N7O8S/c1-7-29(4)37(43(57)58)50-44(59)48-32-20-14-15-26-45-38(52)33(25-27-60-6)46-40(54)35(24-22-31-18-12-9-13-19-31)51(5)42(56)34(23-21-30-16-10-8-11-17-30)47-41(55)36(28(2)3)49-39(32)53/h8-13,16-19,28-29,32-37H,7,14-15,20-27H2,1-6H3,(H,45,52)(H,46,54)(H,47,55)(H,49,53)(H,57,58)(H2,48,50,59) |
| SMILES | CCC(C)C(NC(=O)NC1CCCCNC(=O)C(CCSC)NC(=O)C(CCC2=CC=CC=C2)N(C)C(=O)C(CCC2=CC=CC=C2)NC(=O)C(C(C)C)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 |
