Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027646
PROPERTIES
| NPAID | NPA027646 |
|---|---|
| CLUSTER ID | 283 |
| NODE ID | 257 |
| NAME | Aeruginosin 602 |
| FORMULA | C30H46N6O7 |
| MOLECULAR WEIGHT (Da) | 602.7330 |
| ACCURATE MASS (Da) | 602.3428 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | TWDUPWHWAGIVAS-JZFUDOPHSA-N |
| InChI | InChI=1S/C30H46N6O7/c1-17(2)12-23(35-28(42)26(40)13-18-5-8-21(38)9-6-18)29(43)36-24-15-22(39)10-7-19(24)14-25(36)27(41)34-20(16-37)4-3-11-33-30(31)32/h5-6,8-9,16-17,19-20,22-26,38-40H,3-4,7,10-15H2,1-2H3,(H,34,41)(H,35,42)(H4,31,32,33)/t19-,20?,22?,23+,24-,25+,26+/m0/s1 |
| SMILES | CC(C)C[C@@H](NC(=O)[C@H](O)CC1=CC=C(O)C=C1)C(=O)N1[C@H]2CC(O)CC[C@H]2C[C@@H]1C(=O)NC(C=O)CCCN=C(N)N |
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 |
