Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027404
PROPERTIES
| NPAID | NPA027404 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyanopeptolin 1138 |
| FORMULA | C55H75N7O17S |
| MOLECULAR WEIGHT (Da) | 1138.3040 |
| ACCURATE MASS (Da) | 1137.4940 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Planktothrix |
| ORIGIN SPECIES | sp. NIVA CYA 116 |
| InChIKey | IPSPUQFSLMOERD-UHFFFAOYSA-N |
| InChI | InChI=1S/C55H75N7O17S/c1-8-31(3)45-55(73)79-33(5)46(60-49(67)40(26-20-35-17-23-38(64)24-18-35)56-51(69)43(77-7)30-78-80(74,75)76)52(70)57-39(25-19-34-15-21-37(63)22-16-34)48(66)58-41-27-28-44(65)62(53(41)71)47(32(4)9-2)54(72)61(6)42(50(68)59-45)29-36-13-11-10-12-14-36/h10-18,21-24,31-33,39-47,63-65H,8-9,19-20,25-30H2,1-7H3,(H,56,69)(H,57,70)(H,58,66)(H,59,68)(H,60,67)(H,74,75,76) |
| SMILES | CCC(C)C1NC(=O)C(CC2=CC=CC=C2)N(C)C(=O)C(C(C)CC)N2C(=O)C(CCC2O)NC(=O)C(CCC2=CC=C(O)C=C2)NC(=O)C(NC(=O)C(CCC2=CC=C(O)C=C2)NC(=O)C(COS(=O)(=O)O)OC)C(C)OC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Rounge TB; Rohrlack T; Tooming-Klunderud A; Kristensen T; Jakobsen KS Comparison of cyanopeptolin genes in Planktothrix, Microcystis, and Anabaena strains: evidence for independent evolution within each genus. Applied and Environmental Microbiology 2007 73 (22) 7322-7330. | ||
|---|---|---|---|
| DOI | 10.1128/AEM.01475-07 | PMID | 17921284 |
