Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025230
PROPERTIES
| NPAID | NPA025230 |
|---|---|
| CLUSTER ID | 1969 |
| NODE ID | 1580 |
| NAME | Asperunguisin A |
| FORMULA | C25H40O3 |
| MOLECULAR WEIGHT (Da) | 388.5920 |
| ACCURATE MASS (Da) | 388.2977 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | unguis |
| InChIKey | NGAYUCRULVOMER-NKJUQTNKSA-N |
| InChI | InChI=1S/C25H40O3/c1-14(2)16-9-11-23(4)17(16)10-12-24(5)18-8-7-15(3)21(27)22(28)25(18,6)20(26)13-19(23)24/h10,14,16,18-22,26-28H,3,7-9,11-13H2,1-2,4-6H3/t16-,18+,19-,20-,21-,22+,23+,24+,25-/m0/s1 |
| SMILES | CC(C)[C@@H]1CC[C@@]2(C1=CC[C@]3([C@H]2C[C@@H]([C@@]4([C@@H]3CCC(=C)[C@@H]([C@H]4O)O)C)O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li YL; Gao Y; Liu CY; Sun CJ; Zhao ZT; Lou HX Asperunguisins A-F, Cytotoxic Asperane Sesterterpenoids from the Endolichenic Fungus Aspergillus unguis. Journal of Natural Products 2019 82 (6) 1527-1534. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b01066 | PMID | 31117521 |
