Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028873
PROPERTIES
| NPAID | NPA028873 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Piricyclamide SQWGWRGLSDP |
| FORMULA | C58H79N17O16 |
| MOLECULAR WEIGHT (Da) | 1270.3730 |
| ACCURATE MASS (Da) | 1269.5891 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | aeruginosa NIES843 |
| InChIKey | JZZUYXCMSCYHMW-YSUREIBVSA-N |
| InChI | InChI=1S/C58H79N17O16/c1-29(2)19-38-52(86)73-42(27-76)55(89)72-41(22-48(81)82)57(91)75-18-8-14-44(75)56(90)74-43(28-77)54(88)70-37(15-16-45(59)78)51(85)71-39(20-30-23-63-34-11-5-3-9-32(30)34)50(84)66-26-47(80)68-40(21-31-24-64-35-12-6-4-10-33(31)35)53(87)69-36(13-7-17-62-58(60)61)49(83)65-25-46(79)67-38/h3-6,9-12,23-24,29,36-44,63-64,76-77H,7-8,13-22,25-28H2,1-2H3,(H2,59,78)(H,65,83)(H,66,84)(H,67,79)(H,68,80)(H,69,87)(H,70,88)(H,71,85)(H,72,89)(H,73,86)(H,74,90)(H,81,82)(H4,60,61,62)/t36-,37-,38-,39-,40-,41-,42-,43+,44-/m0/s1 |
| SMILES | CC(C)C[C@@H]1NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC2=C[NH]C3=CC=CC=C23)NC(=O)CNC(=O)[C@H](CC2=C[NH]C3=CC=CC=C23)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CO)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Leikoski N; Fewer DP; Jokela J; Alakoski P; Wahlsten M; Sivonen K Analysis of an inactive cyanobactin biosynthetic gene cluster leads to discovery of new natural products from strains of the genus Microcystis. PLoS One 2012 7 (8) e43002. | ||
|---|---|---|---|
| DOI | 10.1371/journal.pone.0043002 | PMID | 22952627 |
