Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012566
PROPERTIES
| NPAID | NPA012566 |
|---|---|
| CLUSTER ID | 3703 |
| NODE ID | 2785 |
| NAME | Radiosumin B |
| FORMULA | C23H32N4O5 |
| MOLECULAR WEIGHT (Da) | 444.5320 |
| ACCURATE MASS (Da) | 444.2373 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | aeruginosa |
| InChIKey | DXOBDIZQMJWEAT-BMPSSULNSA-N |
| InChI | InChI=1S/C23H32N4O5/c1-14(28)25-19-10-6-17(7-11-19)13-21(23(31)32)27-22(30)20(26-15(2)29)12-16-4-8-18(24-3)9-5-16/h4,6,8,10,12-13,18-21,24H,5,7,9,11H2,1-3H3,(H,25,28)(H,26,29)(H,27,30)(H,31,32)/b16-12-,17-13-/t18-,19-,20-,21-/m0/s1 |
| SMILES | CC(=O)N[C@@H]1CC/C(=C\[C@@H](C(=O)O)NC(=O)[C@H](/C=C/2\CC[C@H](C=C2)NC)NC(=O)C)/C=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Coleman, John E.; Wright, Jeffrey L.C. Radiosumin B, an unusual dipeptide from the cyanobacterium Microcystis aeruginosa Journal of Natural Products 2001 64 (5) 668-670. | ||
|---|---|---|---|
| DOI | 10.1021/np000511z | PMID | 11374973 |
