Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023804
PROPERTIES
| NPAID | NPA023804 |
|---|---|
| CLUSTER ID | 7261 |
| NODE ID | 1144 |
| NAME | Spirodalesol |
| FORMULA | C31H18O8 |
| MOLECULAR WEIGHT (Da) | 518.4770 |
| ACCURATE MASS (Da) | 518.1002 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | eschscholzii |
| InChIKey | MGLQXZJRIOSKCO-UHFFFAOYSA-N |
| InChI | InChI=1S/C31H18O8/c1-39-29(38)31-27(14-4-2-6-18(32)24(14)28(31)37)15-8-10-20(34)26-21(35)11-9-17(23(15)26)30(31)13-12-22(36)25-16(30)5-3-7-19(25)33/h2-13,32-33,35H,1H3 |
| SMILES | COC(=O)C12C(=C3C=CC(=O)C4=C(C=CC(=C34)C15C=CC(=O)C6=C5C=CC=C6O)O)C7=C(C2=O)C(=CC=C7)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Ai Hua; Liu, Wen; Jiang, Nan; Xu, Qiang; Tan, Ren Xiang Spirodalesol, an NLRP3 Inflammasome Activation Inhibitor Organic Letters 2016 18 (24) 6496-6499. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.6b03435 | PMID | 27978645 |
