Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010930
PROPERTIES
| NPAID | NPA010930 |
|---|---|
| CLUSTER ID | 3695 |
| NODE ID | 2779 |
| NAME | Paecilonic acid A |
| FORMULA | C24H44O5 |
| MOLECULAR WEIGHT (Da) | 412.6110 |
| ACCURATE MASS (Da) | 412.3189 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Paecilomyces |
| ORIGIN SPECIES | variotii |
| InChIKey | KIMHBIAVZVBRQI-KHUIQGCPSA-N |
| InChI | InChI=1S/C24H44O5/c1-2-3-4-5-9-12-15-20-21-17-18-22(25)24(28-20,29-21)19-14-11-8-6-7-10-13-16-23(26)27/h20-22,25H,2-19H2,1H3,(H,26,27)/t20-,21+,22-,24-/m0/s1 |
| SMILES | CCCCCCCC[C@H]1[C@H]2CC[C@@H]([C@](O2)(O1)CCCCCCCCCC(=O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Haibo; Hong, Jongki; Yin, Jun; Liu, Juan; Liu, Yonghong; Choi, Jae Sue; Jung, Jee H Paecilonic acids A and B, bicyclic fatty acids from the jellyfish-derived fungus Paecilomyces variotii J08NF-1 Bioorganic and Medicinal Chemistry Letters 2016 26 (9) 2220-2223. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmcl.2016.03.057 | PMID | 27009897 |
