Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA027637
PROPERTIES
NPAID | NPA027637 |
---|---|
CLUSTER ID | 26 |
NODE ID | 25 |
NAME | Cyanopeptolin 920 |
FORMULA | C47H68N8O11 |
MOLECULAR WEIGHT (Da) | 921.1060 |
ACCURATE MASS (Da) | 920.5008 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Microcystis |
ORIGIN SPECIES | sp. |
InChIKey | STNXNBABUAJYEA-UHFFFAOYSA-N |
InChI | InChI=1S/C47H68N8O11/c1-26(2)23-35(49-29(6)56)42(60)53-40-28(5)66-47(65)39(27(3)4)52-43(61)36(24-31-16-18-32(57)19-17-31)54(7)46(64)37(25-30-13-9-8-10-14-30)55-38(58)21-20-34(45(55)63)51-41(59)33(50-44(40)62)15-11-12-22-48/h8-10,13-14,16-19,26-28,33-40,57-58H,11-12,15,20-25,48H2,1-7H3,(H,49,56)(H,50,62)(H,51,59)(H,52,61)(H,53,60) |
SMILES | CC(=O)NC(CC(C)C)C(=O)NC1C(=O)NC(CCCCN)C(=O)NC2CCC(O)N(C2=O)C(CC2=CC=CC=C2)C(=O)N(C)C(CC2=CC=C(O)C=C2)C(=O)NC(C(C)C)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. | ||
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DOI | 10.1016/j.peptides.2006.03.014 | PMID | 16678305 |