Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020777
PROPERTIES
| NPAID | NPA020777 |
|---|---|
| CLUSTER ID | 6521 |
| NODE ID | 11 |
| NAME | Asperlicin E |
| FORMULA | C25H18N4O3 |
| MOLECULAR WEIGHT (Da) | 422.4440 |
| ACCURATE MASS (Da) | 422.1379 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | alliaceus ATCC 20655 |
| InChIKey | HYHLSEUXMRFVND-ZPZUNKDASA-N |
| InChI | InChI=1S/C25H18N4O3/c30-22-14-7-1-4-10-17(14)26-21-20-13-25(32)16-9-3-5-11-18(16)27-24(25)29(20)23(31)15-8-2-6-12-19(15)28(21)22/h1-12,20,24,27,32H,13H2/t20-,24-,25+/m1/s1 |
| SMILES | C1[C@@H]2C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C(=O)N2[C@@H]6[C@]1(C7=CC=CC=C7N6)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liesch JM; Hensens OD; Zink DL; Goetz MA Novel cholecystokinin antagonists from Aspergillus alliaceus. II. Structure determination of asperlicins B, C, D, and E Journal of Antibiotics 1988 41 (7) 878-881. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.41.878 | PMID | 3417562 |
