Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027636
PROPERTIES
| NPAID | NPA027636 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyanopeptolin 1000A |
| FORMULA | C50H80N8O13 |
| MOLECULAR WEIGHT (Da) | 1001.2330 |
| ACCURATE MASS (Da) | 1000.5845 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | DNLVCEDLSFGAHN-UHFFFAOYSA-N |
| InChI | InChI=1S/C50H80N8O13/c1-8-10-11-12-13-17-39(60)52-35(23-25-41(62)63)45(65)56-43-31(6)71-50(70)42(30(5)9-2)55-46(66)37(28-32-18-20-33(59)21-19-32)57(7)49(69)38(27-29(3)4)58-40(61)24-22-36(48(58)68)54-44(64)34(53-47(43)67)16-14-15-26-51/h18-21,29-31,34-38,40,42-43,59,61H,8-17,22-28,51H2,1-7H3,(H,52,60)(H,53,67)(H,54,64)(H,55,66)(H,56,65)(H,62,63) |
| SMILES | CCCCCCCC(=O)NC(CCC(=O)O)C(=O)NC1C(=O)NC(CCCCN)C(=O)NC2CCC(O)N(C2=O)C(CC(C)C)C(=O)N(C)C(CC2=CC=C(O)C=C2)C(=O)NC(C(C)CC)C(=O)OC1C |
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 |
