Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015570
PROPERTIES
| NPAID | NPA015570 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Micropeptin MZ939B |
| FORMULA | C41H65N9O14S |
| MOLECULAR WEIGHT (Da) | 940.0870 |
| ACCURATE MASS (Da) | 939.4372 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | KAYMQKAMCDUXRP-WLQPTDKLSA-N |
| InChI | InChI=1S/C41H65N9O14S/c1-8-22(3)31-40(58)63-24(5)32(48-36(54)29(21-51)64-65(59,60)61)37(55)45-26(16-13-19-44-41(42)43)34(52)46-27-17-18-30(62-7)50(38(27)56)33(23(4)9-2)39(57)49(6)28(35(53)47-31)20-25-14-11-10-12-15-25/h10-12,14-15,22-24,26-33,51H,8-9,13,16-21H2,1-7H3,(H,45,55)(H,46,52)(H,47,53)(H,48,54)(H4,42,43,44)(H,59,60,61)/t22-,23-,24+,26-,27-,28-,29+,30+,31-,32-,33-/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)[C@@H](C)CC)OC)CCCN=C(N)N)NC(=O)[C@@H](CO)OS(=O)(=O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zafrir, Ella; Carmeli, Shmuel Micropeptins from an Israeli fishpond water bloom of the cyanobacterium microcystis sp Journal of Natural Products 2010 73 (3) 352-358. | ||
|---|---|---|---|
| DOI | 10.1021/np900546u | PMID | 20028081 |
