Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020779
PROPERTIES
| NPAID | NPA020779 |
|---|---|
| CLUSTER ID | 2236 |
| NODE ID | 399 |
| NAME | Asperlicin C |
| FORMULA | C25H18N4O2 |
| MOLECULAR WEIGHT (Da) | 406.4450 |
| ACCURATE MASS (Da) | 406.1430 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | alliaceus ATCC 20655 |
| InChIKey | BUTFEAMXSRJHIM-NRFANRHFSA-N |
| InChI | InChI=1S/C25H18N4O2/c30-24-18-9-3-6-12-22(18)29-23(27-20-11-5-2-8-17(20)25(29)31)21(28-24)13-15-14-26-19-10-4-1-7-16(15)19/h1-12,14,21,26H,13H2,(H,28,30)/t21-/m0/s1 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C[C@H]3C4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6C(=O)N3 |
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 |
SYNTHESES
| CITATION 1 | Tseng MC; Yang HY; Chu YH Total synthesis of asperlicin C, circumdatin F, demethylbenzomalvin A, demethoxycircumdatin H, sclerotigenin, and other fused quinazolinones. Organic & Biomolecular Chemistry 2010 8 (2) 419-427. DOI: 10.1039/b910545j PMID: 20066279 | ||
|---|---|---|---|
| CITATION 2 | Tseng MC; Lai CY; Chu YW; Chu YH Tin triflate-mediated total synthesis of circumdatin F, sclerotigenin, asperlicin C, and other quinazolino[3,2-a][1,4]benzodiazepines. Chemical Communications 2009 (4) 445-447. DOI: 10.1039/b813880j PMID: 19137180 | ||
