Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000845126 | Gold | 1 |
| CCMSLIB00005722104 | Gold | 3 |
| CCMSLIB00005722105 | Gold | 3 |
| CCMSLIB00012130648 | Gold | 4 |
| CCMSLIB00009970445 | Gold | 4 |
| CCMSLIB00000839193 | Gold | 3 |
COMPOUND NPA031742
PROPERTIES
| NPAID | NPA031742 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | (+)-neoechinulin A |
| FORMULA | C19H21N3O2 |
| MOLECULAR WEIGHT (Da) | 323.3960 |
| ACCURATE MASS (Da) | 323.1634 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sp. |
| InChIKey | MYRPIYZIAHOECW-MKVLZVNKSA-N |
| InChI | InChI=1S/C19H21N3O2/c1-5-19(3,4)16-13(12-8-6-7-9-14(12)21-16)10-15-18(24)20-11(2)17(23)22-15/h5-11,21H,1H2,2-4H3,(H,20,24)(H,22,23)/b15-10-/t11-/m1/s1 |
| SMILES | C=CC(C)(C)C1=C(/C=C2\NC(=O)[C@@H](C)NC2=O)C2=CC=CC=C2N1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wei, Xia; Feng, Chan; Wang, Si-Yu; Zhang, Dong-Mei; Li, Xiao-Hui; Zhang, Cui-Xian New Indole Diketopiperazine Alkaloids from Soft Coral-Associated Epiphytic Fungus Aspergillus sp. EGF 15-0-3. Chemistry and Biodiversity 2020 17 (5) e2000106. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.202000106 | PMID | 32212241 |
