Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006292
PROPERTIES
| NPAID | NPA006292 |
|---|---|
| CLUSTER ID | 111 |
| NODE ID | 105 |
| NAME | Berkazaphilone B |
| FORMULA | C21H22O7 |
| MOLECULAR WEIGHT (Da) | 386.4000 |
| ACCURATE MASS (Da) | 386.1366 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | rubrum |
| InChIKey | JCQWLKQBYHSHOG-NRKPLWJESA-N |
| InChI | InChI=1S/C21H22O7/c1-4-5-14-7-12-8-17(24)21(3,19(25)15(12)10-27-14)28-20(26)18-11(2)6-13(22)9-16(18)23/h4-9,15,19,22-23,25H,10H2,1-3H3/b5-4+/t15-,19+,21-/m0/s1 |
| SMILES | C/C=C/C1=CC2=CC(=O)[C@]([C@@H]([C@H]2CO1)O)(C)OC(=O)C3=C(C=C(C=C3C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Stierle, Andrea A.; Stierle, Donald B.; Girtsman, Teri Caspase-1 inhibitors from an extremophilic fungus that target specific leukemia cell lines Journal of Natural Products 2012 75 (3) 344-350. | ||
|---|---|---|---|
| DOI | 10.1021/np200414c | PMID | 22295871 |
