Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000850511 | Gold | 1 |
COMPOUND NPA010838
PROPERTIES
| NPAID | NPA010838 |
|---|---|
| CLUSTER ID | 4271 |
| NODE ID | 148 |
| NAME | Myrocin A |
| FORMULA | C20H22O6 |
| MOLECULAR WEIGHT (Da) | 358.3900 |
| ACCURATE MASS (Da) | 358.1416 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Apiospora |
| ORIGIN SPECIES | montagnei |
| InChIKey | XKJPVKHJPNQLKG-KPHJKFSFSA-N |
| InChI | InChI=1S/C20H22O6/c1-4-17(2)8-11-13(22)14(23)15-18(3,16(24)25)6-5-10-7-19(10,15)20(11,26)12(21)9-17/h4,8,10,23,26H,1,5-7,9H2,2-3H3,(H,24,25)/t10-,17+,18-,19-,20-/m1/s1 |
| SMILES | C[C@]1(CC[C@@H]2C[C@]23C1=C(C(=O)C4=C[C@](CC(=O)[C@@]34O)(C)C=C)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Klemke, Christine; Kehraus, Stefan; Wright, Anthony D.; Koenig, Gabriele M. New secondary metabolites from the marine endophytic fungus Apiospora montagnei Journal of Natural Products 2004 67 (6) 1058-1063. | ||
|---|---|---|---|
| DOI | 10.1021/np034061x | PMID | 15217297 |
