Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005436485 | Gold | 3 |
COMPOUND NPA026614
PROPERTIES
| NPAID | NPA026614 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Scopularide E |
| FORMULA | C33H59N5O7 |
| MOLECULAR WEIGHT (Da) | 637.8630 |
| ACCURATE MASS (Da) | 637.4414 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Beauveria |
| ORIGIN SPECIES | sp. CMB-F585 |
| InChIKey | BVIZHARSPLOVRS-MRIMINFRSA-N |
| InChI | InChI=1S/C33H59N5O7/c1-10-11-12-13-14-21(6)16-22(7)26-17-27(39)34-18-28(40)38-29(20(4)5)32(43)37-25(15-19(2)3)31(42)35-23(8)30(41)36-24(9)33(44)45-26/h19-26,29H,10-18H2,1-9H3,(H,34,39)(H,35,42)(H,36,41)(H,37,43)(H,38,40)/t21-,22-,23-,24-,25+,26-,29-/m0/s1 |
| SMILES | CCCCCC[C@H](C)C[C@H](C)[C@@H]1CC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Elbanna, Ahmed H.; Khalil, Zeinab G.; Bernhardt, Paul V.; Capon, Robert J. Scopularides revisited: Molecular networking guided exploration of lipodepsipeptides in Australian marine fish gastrointestinal tract-derived fungi Marine Drugs 2019 17 (8) None. | ||
|---|---|---|---|
| DOI | 10.3390/md17080475 | PMID | 31426405 |
