Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008879
PROPERTIES
| NPAID | NPA008879 |
|---|---|
| CLUSTER ID | 683 |
| NODE ID | 603 |
| NAME | Eryngiolide A |
| FORMULA | C20H30O8 |
| MOLECULAR WEIGHT (Da) | 398.4520 |
| ACCURATE MASS (Da) | 398.1941 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Pleurotus |
| ORIGIN SPECIES | eryngii |
| InChIKey | GHZVTIKGATYJRL-WZRMTEHQSA-N |
| InChI | InChI=1S/C20H30O8/c1-9-11-5-7-19(3,25)16(22)14-12(10(2)18(24)28-14)6-8-20(4,26)15(21)13(11)27-17(9)23/h10-16,21-22,25-26H,1,5-8H2,2-4H3/t10-,11-,12-,13+,14+,15-,16-,19+,20+/m1/s1 |
| SMILES | C[C@@H]1[C@H]2CC[C@]([C@@H]([C@@H]3[C@H](CC[C@]([C@@H]([C@H]2OC1=O)O)(C)O)C(=C)C(=O)O3)O)(C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Shao-juan; Li, Yong-xia; Bao, Li; Han, Jun-jie; Yang, Xiao-li; Li, He-ran; Wang, Ya-qi; Li, Shao-jie; Liu, Hong-wei Eryngiolide A, a cytotoxic macrocyclic diterpenoid with an unusual cyclododecane core skeleton produced by the edible mushroom Pleurotus eryngii Organic Letters 2012 14 (14) 3672-3675. | ||
|---|---|---|---|
| DOI | 10.1021/ol301519m | PMID | 22769974 |
