Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027462
PROPERTIES
| NPAID | NPA027462 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | Nodulapeptin 849 |
| FORMULA | C44H63N7O10 |
| MOLECULAR WEIGHT (Da) | 850.0270 |
| ACCURATE MASS (Da) | 849.4636 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena |
| InChIKey | NCWPSTXGSLXTDR-UHFFFAOYSA-N |
| InChI | InChI=1S/C44H63N7O10/c1-7-28(4)37(43(58)59)50-44(60)48-32-20-14-15-25-45-38(53)34(26-61-29(5)52)47-40(55)35(24-22-31-18-12-9-13-19-31)51(6)42(57)33(23-21-30-16-10-8-11-17-30)46-41(56)36(27(2)3)49-39(32)54/h8-13,16-19,27-28,32-37H,7,14-15,20-26H2,1-6H3,(H,45,53)(H,46,56)(H,47,55)(H,49,54)(H,58,59)(H2,48,50,60) |
| 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)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 |
