Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025184
PROPERTIES
| NPAID | NPA025184 |
|---|---|
| CLUSTER ID | 7657 |
| NODE ID | 2051 |
| NAME | Puniceloid A |
| FORMULA | C20H19N3O4 |
| MOLECULAR WEIGHT (Da) | 365.3890 |
| ACCURATE MASS (Da) | 365.1376 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | puniceus |
| InChIKey | BFZLJEPIUQRETA-ODXCJYRJSA-N |
| InChI | InChI=1S/C20H19N3O4/c1-12-17(25)22-20(27-2,11-13-7-4-3-5-8-13)19-21-16-14(18(26)23(12)19)9-6-10-15(16)24/h3-10,12,24H,11H2,1-2H3,(H,22,25)/t12-,20+/m1/s1 |
| SMILES | C[C@@H]1C(=O)N[C@@](C2=NC3=C(C=CC=C3O)C(=O)N12)(CC4=CC=CC=C4)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liang X; Zhang X; Lu X; Zheng Z; Ma X; Qi S Diketopiperazine-Type Alkaloids from a Deep-Sea-Derived Aspergillus puniceus Fungus and Their Effects on Liver X Receptor α. Journal of Natural Products 2019 82 (6) 1558-1564. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.9b00055 | PMID | 31095389 |
