Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028798
PROPERTIES
| NPAID | NPA028798 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | [MeHph5] Nodulapeptin B |
| FORMULA | C44H63N7O11S |
| MOLECULAR WEIGHT (Da) | 898.0930 |
| ACCURATE MASS (Da) | 897.4306 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena |
| InChIKey | OJSBBUXEMSSZOX-UHFFFAOYSA-N |
| InChI | InChI=1S/C44H63N7O11S/c1-6-28(2)37(43(58)59)50-44(60)49-32-19-13-14-25-45-38(53)35(27-62-29(3)52)48-41(56)36(23-21-31-17-11-8-12-18-31)51(4)42(57)34(22-20-30-15-9-7-10-16-30)47-40(55)33(46-39(32)54)24-26-63(5)61/h7-12,15-18,28,32-37H,6,13-14,19-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,55)(H,48,56)(H,58,59)(H2,49,50,60) |
| 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(CCS(C)=O)NC1=O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Spoof L; Błaszczyk A; Meriluoto J; Cegłowska M; Mazur-Marzec H Structures and Activity of New Anabaenopeptins Produced by Baltic Sea Cyanobacteria. Marine Drugs 2015 14 (1) 8. | ||
|---|---|---|---|
| DOI | 10.3390/md14010008 | PMID | 26729139 |
