Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027638
PROPERTIES
| NPAID | NPA027638 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyanopeptolin 959 |
| FORMULA | C43H61N9O14S |
| MOLECULAR WEIGHT (Da) | 960.0770 |
| ACCURATE MASS (Da) | 959.4059 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | JAQFKPSIKFQVIW-UHFFFAOYSA-N |
| InChI | InChI=1S/C43H61N9O14S/c1-5-24(2)34-42(61)66-25(3)35(50-38(57)32(53)23-65-67(62,63)64)39(58)47-28(17-12-20-46-43(44)45)36(55)48-29-18-19-33(54)52(40(29)59)31(22-27-15-10-7-11-16-27)41(60)51(4)30(37(56)49-34)21-26-13-8-6-9-14-26/h6-11,13-16,24-25,28-35,53-54H,5,12,17-23H2,1-4H3,(H,47,58)(H,48,55)(H,49,56)(H,50,57)(H4,44,45,46)(H,62,63,64) |
| SMILES | CCC(C)C1NC(=O)C(CC2=CC=CC=C2)N(C)C(=O)C(CC2=CC=CC=C2)N2C(=O)C(CCC2O)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(O)COS(=O)(=O)O)C(C)OC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Welker M; Marsálek B; Sejnohová L; von Döhren H Detection and identification of oligopeptides in Microcystis (cyanobacteria) colonies: toward an understanding of metabolic diversity. Peptides 2006 27 (9) 2090-2103. | ||
|---|---|---|---|
| DOI | 10.1016/j.peptides.2006.03.014 | PMID | 16678305 |
