Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005436486 | Gold | 3 |
COMPOUND NPA026615
PROPERTIES
| NPAID | NPA026615 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Scopularide F |
| FORMULA | C40H65N5O7 |
| MOLECULAR WEIGHT (Da) | 727.9880 |
| ACCURATE MASS (Da) | 727.4884 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Beauveria |
| ORIGIN SPECIES | sp. CMB-F585 |
| InChIKey | DFFYMZZNXYPOIR-XRLGKLQESA-N |
| InChI | InChI=1S/C40H65N5O7/c1-9-11-12-14-17-27(7)21-28(8)33-23-34(46)41-24-35(47)45-36(26(5)6)39(50)43-31(20-25(3)4)38(49)42-30(10-2)37(48)44-32(40(51)52-33)22-29-18-15-13-16-19-29/h13,15-16,18-19,25-28,30-33,36H,9-12,14,17,20-24H2,1-8H3,(H,41,46)(H,42,49)(H,43,50)(H,44,48)(H,45,47)/t27-,28-,30-,31+,32-,33-,36-/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](CC)C(=O)N[C@@H](CC2=CC=CC=C2)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 |
