Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028805
PROPERTIES
| NPAID | NPA028805 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | Nodulapeptin 855a |
| FORMULA | C42H61N7O10S |
| MOLECULAR WEIGHT (Da) | 856.0560 |
| ACCURATE MASS (Da) | 855.4201 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena |
| InChIKey | CWANKXLXOYMBBJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C42H61N7O10S/c1-5-26(2)35(41(57)58)48-42(59)47-30-13-9-10-23-43-36(52)33(25-50)46-39(55)34(21-17-28-14-18-29(51)19-15-28)49(3)40(56)32(20-16-27-11-7-6-8-12-27)45-38(54)31(22-24-60-4)44-37(30)53/h6-8,11-12,14-15,18-19,26,30-35,50-51H,5,9-10,13,16-17,20-25H2,1-4H3,(H,43,52)(H,44,53)(H,45,54)(H,46,55)(H,57,58)(H2,47,48,59) |
| SMILES | CCC(C)C(NC(=O)NC1CCCCNC(=O)C(CO)NC(=O)C(CCC2=CC=C(O)C=C2)N(C)C(=O)C(CCC2=CC=CC=C2)NC(=O)C(CCSC)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 |
