Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027444
PROPERTIES
| NPAID | NPA027444 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Micropeptin KB970C |
| FORMULA | C47H74N10O12 |
| MOLECULAR WEIGHT (Da) | 971.1670 |
| ACCURATE MASS (Da) | 970.5488 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | CDRWZRYLRIEYIE-TZWUAHKLSA-N |
| InChI | InChI=1S/C47H74N10O12/c1-10-11-13-20-34(58)51-32(25-36(59)68-9)41(61)55-38-28(6)69-46(66)37(26(2)3)54-42(62)33(24-29-17-14-12-15-18-29)56(7)45(65)39(27(4)5)57-35(67-8)22-21-31(44(57)64)53-40(60)30(52-43(38)63)19-16-23-50-47(48)49/h12,14-15,17-18,26-28,30-33,35,37-39H,10-11,13,16,19-25H2,1-9H3,(H,51,58)(H,52,63)(H,53,60)(H,54,62)(H,55,61)(H4,48,49,50)/t28-,30-,31-,32+,33-,35+,37-,38-,39-/m0/s1 |
| SMILES | CCCCCC(=O)N[C@H](CC(=O)OC)C(=O)N[C@@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H]2CC[C@@H](OC)N(C2=O)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)O[C@H]1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Elkobi-Peer S; Carmeli S New prenylated aeruginosin, microphycin, anabaenopeptin and micropeptin analogues from a Microcystis bloom material collected in Kibbutz Kfar Blum, Israel. Marine Drugs 2015 13 (4) 2347-2375. | ||
|---|---|---|---|
| DOI | 10.3390/md13042347 | PMID | 25884445 |
