Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000256
PROPERTIES
| NPAID | NPA000256 |
|---|---|
| CLUSTER ID | 218 |
| NODE ID | 205 |
| NAME | Inotilone |
| FORMULA | C12H10O4 |
| MOLECULAR WEIGHT (Da) | 218.2080 |
| ACCURATE MASS (Da) | 218.0579 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Inonotus |
| ORIGIN SPECIES | sp. |
| InChIKey | NLZQGBCUKNUDED-SDQBBNPISA-N |
| InChI | InChI=1S/C12H10O4/c1-7-4-11(15)12(16-7)6-8-2-3-9(13)10(14)5-8/h2-6,13-14H,1H3/b12-6- |
| SMILES | CC1=CC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wangun, Hilaire V Kemami; Härtl, Albert; Tam Kiet, Trinh; Hertweck, Christian Inotilone and related phenylpropanoid polyketides from Inonotus sp. and their identification as potent COX and XO inhibitors Organic & Biomolecular Chemistry 2006 4 (13) 2545-2548. | ||
|---|---|---|---|
| DOI | 10.1039/b604505g | PMID | 16791316 |
